4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole

C149H185F3N21O+ — CID 158946970

IUPAC4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole
SMILESCC(C)(C)c1c(F)cccc1-n1cccn1.CC(C)(C)c1cc(F)ccc1[N+]1=NCC=C1.CC(C)(C)c1ccc(-c2cc[nH]c2)cc1.CC(C)(C)c1ccc(-c2ccn[nH]2)cc1.CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1cccc(-c2ccn[nH]2)c1.CC(C)(C)c1cccc(-c2cn[nH]c2)c1.COc1ccc(C(C)(C)C)cc1-c1ccn(C)n1.Cc1cnn(-c2cccc(C(C)(C)C)c2)c1.Cn1cc(-c2ccc(F)c(C(C)(C)C)c2)cn1.Cn1cc(-c2cccc(C(C)(C)C)c2)cn1
InChIInChI=1S/C15H20N2O.C14H17FN2.2C14H18N2.C14H17N.C13H16FN2.C13H15FN2.4C13H16N2/c1-15(2,3)11-6-7-14(18-5)12(10-11)13-8-9-17(4)16-13;1-14(2,3)12-7-10(5-6-13(12)15)11-8-16-17(4)9-11;1-14(2,3)13-7-5-6-11(8-13)12-9-15-16(4)10-12;1-11-9-15-16(10-11)13-7-5-6-12(8-13)14(2,3)4;1-14(2,3)13-6-4-11(5-7-13)12-8-9-15-10-12;1-13(2,3)11-9-10(14)5-6-12(11)16-8-4-7-15-16;1-13(2,3)12-10(14)6-4-7-11(12)16-9-5-8-15-16;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15;1-13(2,3)11-6-4-10(5-7-11)12-8-9-14-15-12;1-13(2,3)12-6-4-5-10(7-12)11-8-14-15-9-11;1-13(2,3)11-6-4-5-10(9-11)12-7-8-14-15-12/h6-10H,1-5H3;5-9H,1-4H3;2*5-10H,1-4H3;4-10,15H,1-3H3;4-6,8-9H,7H2,1-3H3;4-9H,1-3H3;4-10H,1-3H3;3*4-9H,1-3H3,(H,14,15)/q;;;;;+1;;;;;
InChIKeyXOJLSVIPBSQHTD-UHFFFAOYSA-N
MW2343.26 g/mol
LogP38.11
Rot. Bonds12

About 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole

4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole (PubChem CID 158946970) has the molecular formula C149H185F3N21O+ and a molecular weight of 2343.26 g/mol. Its IUPAC name is 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole.

Molecular Properties

Compound Name4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole
PubChem CID158946970
Molecular FormulaC149H185F3N21O+
Molecular Weight2343.26 g/mol
Exact Mass2341.50
IUPAC Name4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole
SMILESCC(C)(C)c1c(F)cccc1-n1cccn1.CC(C)(C)c1cc(F)ccc1[N+]1=NCC=C1.CC(C)(C)c1ccc(-c2cc[nH]c2)cc1.CC(C)(C)c1ccc(-c2ccn[nH]2)cc1.CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1cccc(-c2ccn[nH]2)c1.CC(C)(C)c1cccc(-c2cn[nH]c2)c1.COc1ccc(C(C)(C)C)cc1-c1ccn(C)n1.Cc1cnn(-c2cccc(C(C)(C)C)c2)c1.Cn1cc(-c2ccc(F)c(C(C)(C)C)c2)cn1.Cn1cc(-c2cccc(C(C)(C)C)c2)cn1
InChIInChI=1S/C15H20N2O.C14H17FN2.2C14H18N2.C14H17N.C13H16FN2.C13H15FN2.4C13H16N2/c1-15(2,3)11-6-7-14(18-5)12(10-11)13-8-9-17(4)16-13;1-14(2,3)12-7-10(5-6-13(12)15)11-8-16-17(4)9-11;1-14(2,3)13-7-5-6-11(8-13)12-9-15-16(4)10-12;1-11-9-15-16(10-11)13-7-5-6-12(8-13)14(2,3)4;1-14(2,3)13-6-4-11(5-7-13)12-8-9-15-10-12;1-13(2,3)11-9-10(14)5-6-12(11)16-8-4-7-15-16;1-13(2,3)12-10(14)6-4-7-11(12)16-9-5-8-15-16;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15;1-13(2,3)11-6-4-10(5-7-11)12-8-9-14-15-12;1-13(2,3)12-6-4-5-10(7-12)11-8-14-15-9-11;1-13(2,3)11-6-4-5-10(9-11)12-7-8-14-15-12/h6-10H,1-5H3;5-9H,1-4H3;2*5-10H,1-4H3;4-10,15H,1-3H3;4-6,8-9H,7H2,1-3H3;4-9H,1-3H3;4-10H,1-3H3;3*4-9H,1-3H3,(H,14,15)/q;;;;;+1;;;;;
InChIKeyXOJLSVIPBSQHTD-UHFFFAOYSA-N
XLogP38.11
TPSA233.35 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds12
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002343.26
LogP ≤ 538.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole with MolForge

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Related Compounds

N-[[5-[1-[1-[2-[3-fluoro-5-[2-(5-pyrimidin-5-yl-1H-indazol-3-yl)-1H-indol-4-yl]phenoxy]ethyl]pyrrolidin-3-yl]-3-[4-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-indol-2-yl]indazol-5-yl]-3-pyridinyl]methyl]-1-phenylmethanamine
CID 137088523
5-(2,3-dimethylimidazol-4-yl)-3-[4-(3-fluoro-5-methoxyphenyl)-1H-indol-2-yl]-1H-indazole
CID 137115431
1-(2-tert-butyl-4-fluorophenyl)-1,2,4-triazole;1-(2-tert-butyl-6-fluorophenyl)-1,2,4-triazole;1-(2-tert-butyl-4-methoxyphenyl)-1,2,4-triazole;1-(2-tert-butyl-6-methoxyphenyl)triazole;1-(2-tert-butyl-4-methylphenyl)-1,2,4-triazole;bis(1-(2-tert-butyl-5-methylphenyl)-1,2,4-triazole);1-(2-tert-butylphenyl)-3-methyl-1,2,4-triazole;1-(2-tert-butylphenyl)-4-methyltriazole;3-(2-tert-butylphenyl)-5-methyl-1H-1,2,4-triazole;5-(2-tert-butylphenyl)-1H-pyrazole;1-(2-tert-butylphenyl)triazole;1-(2-tert-butylphenyl)-1,2,4-triazole;1-(3-tert-butylphenyl)-1,2,4-triazole;1-[2-tert-butyl-4-(trifluoromethyl)phenyl]-1,2,4-triazole
CID 160411942
1-(2-tert-butyl-4-fluorophenyl)-1,2,4-triazole;1-(2-tert-butyl-4-methoxyphenyl)-1,2,4-triazole;1-(2-tert-butyl-4-methylphenyl)-1,2,4-triazole;bis(1-(2-tert-butyl-5-methylphenyl)-1,2,4-triazole);1-(2-tert-butyl-6-methylphenyl)-1,2,4-triazole;1-(2-tert-butylphenyl)-3-methyl-1,2,4-triazole;3-(2-tert-butylphenyl)-5-methyl-1H-1,2,4-triazole;5-(2-tert-butylphenyl)-1H-pyrazole;1-(2-tert-butylphenyl)triazole;1-(2-tert-butylphenyl)-1,2,4-triazole;1-(3-tert-butylphenyl)-1,2,4-triazole;1-[2-tert-butyl-4-(trifluoromethyl)phenyl]-1,2,4-triazole;methane
CID 160415596
CID 162056230
CID 162056230
CID 167690800
CID 167690800
1-(2-tert-butyl-4-fluorophenyl)-1,2,4-triazole;1-(2-tert-butyl-4-methoxyphenyl)-1,2,4-triazole;1-(2-tert-butyl-6-methoxyphenyl)triazole;1-(2-tert-butyl-4-methylphenyl)-1,2,4-triazole;bis(1-(2-tert-butyl-5-methylphenyl)-1,2,4-triazole);1-(2-tert-butyl-6-methylphenyl)-1,2,4-triazole;1-(2-tert-butylphenyl)-3-methyl-1,2,4-triazole;1-(2-tert-butylphenyl)-4-methyltriazole;3-(2-tert-butylphenyl)-5-methyl-1H-1,2,4-triazole;1-(2-tert-butylphenyl)triazole;1-(2-tert-butylphenyl)-1,2,4-triazole;1-(3-tert-butylphenyl)-1,2,4-triazole;5-(2-tert-butylphenyl)-1H-1,2,4-triazole;1-[2-tert-butyl-4-(trifluoromethyl)phenyl]-1,2,4-triazole
CID 168397276
3-[6-[1-[(4-methoxyphenyl)methyl]pyrazol-4-yl]imidazo[2,1-e]pyrazol-1-yl]-4-methyl-N-[[3-(2-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]methyl]aniline
CID 152380159
[2-[5-isoquinolin-4-yl-1-[(4-methoxyphenyl)methyl]indazol-3-yl]-1H-benzimidazol-4-yl]methanol;4-[1-[(4-methoxyphenyl)methyl]-3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]indazol-5-yl]isoquinoline;pyrrolidine;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline
CID 157383395
1-(2-Tert-butyl-3-fluorophenyl)-1,2,4-triazole;1-(2-tert-butyl-4-fluorophenyl)-1,2,4-triazole;2-(3-tert-butyl-4-fluorophenyl)triazole;1-(3-tert-butyl-5-methoxyphenyl)-1,2,4-triazole;1-(2-tert-butyl-4-methylphenyl)pyrazole;1-(3-tert-butyl-5-methylphenyl)-1,2,4-triazole;tris(2-(3-tert-butyl-5-methylphenyl)triazole);1-(2-tert-butylphenyl)-3-methyl-1,2,4-triazole;1-(3-tert-butylphenyl)-3-methyl-1,2,4-triazole;1-(2-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)pyrazole;1-(2-tert-butylphenyl)-1,2,4-triazole;1-(3-tert-butylphenyl)-1,2,4-triazole
CID 157646642
3-[2-[5-[(3-fluoro-5-methylphenyl)methyl]-4-[3-(1H-imidazol-5-yl)propyl]-1,2,4-triazol-3-yl]ethyl]-1H-indole;bis(3-[2-[4-[3-(1H-imidazol-5-yl)propyl]-5-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]ethyl]-1H-indole);3-(3H-inden-1-ylmethyl)-5-[(4-methoxyphenyl)methyl]-4-[3-(3H-pyrrol-5-yl)propyl]-1,2,4-triazole;3-[(6-methoxy-3H-inden-1-yl)methyl]-5-[(4-methylphenyl)methyl]-4-[3-(3H-pyrrol-5-yl)propyl]-1,2,4-triazole
CID 157963663
N,N-dimethyl-1-[2-[5-(4-methyl-5-pyridin-4-yl-3-pyridinyl)-1H-indazol-3-yl]-1H-benzimidazol-4-yl]methanamine;1-[2-[1-[(4-methoxyphenyl)methyl]-5-(4-methyl-5-pyridin-4-yl-3-pyridinyl)indazol-3-yl]-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;1-[2-[1-[(4-methoxyphenyl)methyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-3-yl]-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine
CID 158004990

Frequently Asked Questions

What is the IUPAC name of 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole?
The IUPAC name of 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole (CID 158946970) is 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole.
What is the SMILES notation for 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole?
The canonical SMILES for 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole is CC(C)(C)c1c(F)cccc1-n1cccn1.CC(C)(C)c1cc(F)ccc1[N+]1=NCC=C1.CC(C)(C)c1ccc(-c2cc[nH]c2)cc1.CC(C)(C)c1ccc(-c2ccn[nH]2)cc1.CC(C)(C)c1ccc(-n2ccnc2)cc1.CC(C)(C)c1cccc(-c2ccn[nH]2)c1.CC(C)(C)c1cccc(-c2cn[nH]c2)c1.COc1ccc(C(C)(C)C)cc1-c1ccn(C)n1.Cc1cnn(-c2cccc(C(C)(C)C)c2)c1.Cn1cc(-c2ccc(F)c(C(C)(C)C)c2)cn1.Cn1cc(-c2cccc(C(C)(C)C)c2)cn1.
What is the InChIKey of 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole?
The InChIKey is XOJLSVIPBSQHTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O.C14H17FN2.2C14H18N2.C14H17N.C13H16FN2.C13H15FN2.4C13H16N2/c1-15(2,3)11-6-7-14(18-5)12(10-11)13-8-9-17(4)16-13;1-14(2,3)12-7-10(5-6-13(12)15)11-8-16-17(4)9-11;1-14(2,3)13-7-5-6-11(8-13)12-9-15-16(4)10-12;1-11-9-15-16(10-11)13-7-5-6-12(8-13)14(2,3)4;1-14(2,3)13-6-4-11(5-7-13)12-8-9-15-10-12;1-13(2,3)11-9-10(14)5-6-12(11)16-8-4-7-15-16;1-13(2,3)12-10(14)6-4-7-11(12)16-9-5-8-15-16;1-13(2,3)11-4-6-12(7-5-11)15-9-8-14-10-15;1-13(2,3)11-6-4-10(5-7-11)12-8-9-14-15-12;1-13(2,3)12-6-4-5-10(7-12)11-8-14-15-9-11;1-13(2,3)11-6-4-5-10(9-11)12-7-8-14-15-12/h6-10H,1-5H3;5-9H,1-4H3;2*5-10H,1-4H3;4-10,15H,1-3H3;4-6,8-9H,7H2,1-3H3;4-9H,1-3H3;4-10H,1-3H3;3*4-9H,1-3H3,(H,14,15)/q;;;;;+1;;;;;.
What are the key properties of 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole?
4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole has a molecular weight of 2343.26 g/mol, XLogP of 38.11, 12 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-tert-butyl-4-fluorophenyl)-1-methylpyrazole;1-(2-tert-butyl-3-fluorophenyl)pyrazole;1-(2-tert-butyl-4-fluorophenyl)-3H-pyrazol-1-ium;3-(5-tert-butyl-2-methoxyphenyl)-1-methylpyrazole;1-(4-tert-butylphenyl)imidazole;1-(3-tert-butylphenyl)-4-methylpyrazole;4-(3-tert-butylphenyl)-1-methylpyrazole;4-(3-tert-butylphenyl)-1H-pyrazole;5-(3-tert-butylphenyl)-1H-pyrazole;5-(4-tert-butylphenyl)-1H-pyrazole;3-(4-tert-butylphenyl)-1H-pyrrole is sourced from PubChem (CID 158946970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).