(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one

C119H119N23O8S — CID 158230216

IUPAC(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one
SMILESC#Cc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.C#Cc1cccc(-c2cccc([C@]3(C)CC(=O)N(C)C(N)=N3)n2)c1.C#Cc1cccc(-c2ccnc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)c1.CC#Cc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.CC#Cc1cccc(-c2coc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)c1.[H]/N=C1/C[C@](C)(c2cc(-c3cncc(C#CC)c3)cs2)C(N2CCOCC2)C(=O)N1C
InChIInChI=1S/C23H26N4O2S.C20H20N4O.3C19H18N4O.C19H19N3O2/c1-4-5-16-10-17(14-25-13-16)18-11-19(30-15-18)23(2)12-20(24)26(3)22(28)21(23)27-6-8-29-9-7-27;1-4-6-14-7-5-8-15(11-14)17-12-16(9-10-22-17)20(2)13-18(25)24(3)19(21)23-20;1-4-13-7-5-8-14(11-13)15-9-6-10-16(21-15)19(2)12-17(24)23(3)18(20)22-19;1-4-13-6-5-7-14(10-13)16-11-15(8-9-21-16)19(2)12-17(24)23(3)18(20)22-19;1-4-13-6-5-7-14(10-13)15-8-9-21-16(11-15)19(2)12-17(24)23(3)18(20)22-19;1-4-6-13-7-5-8-14(9-13)15-10-16(24-12-15)19(2)11-17(23)22(3)18(20)21-19/h10-11,13-15,21,24H,6-9,12H2,1-3H3;5,7-12H,13H2,1-3H3,(H2,21,23);3*1,5-11H,12H2,2-3H3,(H2,20,22);5,7-10,12H,11H2,1-3H3,(H2,20,21)/b24-20-;;;;;/t21?,23-;20-;4*19-/m100000/s1
InChIKeyGEHCYIJGFPQXTE-SVKZDQQKSA-N
MW2031.48 g/mol
LogP14.57
Rot. Bonds13

About (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one

(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one (PubChem CID 158230216) has the molecular formula C119H119N23O8S and a molecular weight of 2031.48 g/mol. Its IUPAC name is (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one.

Molecular Properties

Compound Name(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one
PubChem CID158230216
Molecular FormulaC119H119N23O8S
Molecular Weight2031.48 g/mol
Exact Mass2029.93
IUPAC Name(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one
SMILESC#Cc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.C#Cc1cccc(-c2cccc([C@]3(C)CC(=O)N(C)C(N)=N3)n2)c1.C#Cc1cccc(-c2ccnc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)c1.CC#Cc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.CC#Cc1cccc(-c2coc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)c1.[H]/N=C1/C[C@](C)(c2cc(-c3cncc(C#CC)c3)cs2)C(N2CCOCC2)C(=O)N1C
InChIInChI=1S/C23H26N4O2S.C20H20N4O.3C19H18N4O.C19H19N3O2/c1-4-5-16-10-17(14-25-13-16)18-11-19(30-15-18)23(2)12-20(24)26(3)22(28)21(23)27-6-8-29-9-7-27;1-4-6-14-7-5-8-15(11-14)17-12-16(9-10-22-17)20(2)13-18(25)24(3)19(21)23-20;1-4-13-7-5-8-14(11-13)15-9-6-10-16(21-15)19(2)12-17(24)23(3)18(20)22-19;1-4-13-6-5-7-14(10-13)16-11-15(8-9-21-16)19(2)12-17(24)23(3)18(20)22-19;1-4-13-6-5-7-14(10-13)15-8-9-21-16(11-15)19(2)12-17(24)23(3)18(20)22-19;1-4-6-13-7-5-8-14(9-13)15-10-16(24-12-15)19(2)11-17(23)22(3)18(20)21-19/h10-11,13-15,21,24H,6-9,12H2,1-3H3;5,7-12H,13H2,1-3H3,(H2,21,23);3*1,5-11H,12H2,2-3H3,(H2,20,22);5,7-10,12H,11H2,1-3H3,(H2,20,21)/b24-20-;;;;;/t21?,23-;20-;4*19-/m100000/s1
InChIKeyGEHCYIJGFPQXTE-SVKZDQQKSA-N
XLogP14.57
TPSA427.67 Ų
H-Bond Donors6
H-Bond Acceptors26
Rotatable Bonds13
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002031.48
LogP ≤ 514.57
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one with MolForge

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Launch Full Analysis

Related Compounds

N-benzyl-2,2-dimethylpropanamide;N-(3,3-dimethylbut-1-en-2-yl)-N-methylpyridin-2-amine;2,2-dimethyl-N-[(4-methylphenyl)methyl]propanamide;2,2-dimethyl-N-(1-phenylcyclopropyl)propanamide;bis(2,2-dimethyl-N-(1-phenylethyl)propanamide);2,2-dimethyl-N-phenylpropanamide;2,2-dimethyl-N-(1-pyridin-3-ylcyclopropyl)propanamide;2,2-dimethyl-N-(pyridin-3-ylmethyl)propanamide;2,2-dimethyl-N-(1-pyridin-2-ylpropyl)propanamide;3,3-dimethyl-N-(thiophen-2-ylmethyl)but-1-en-2-amine;N-[(2-fluorophenyl)methyl]-2,2-dimethylpropanamide;N-(furan-2-ylmethyl)-2,2-dimethylpropanamide
CID 158340459
(6S)-2-amino-3,6-dimethyl-5-morpholin-4-yl-6-[4-(5-propyl-3-pyridinyl)thiophen-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one
CID 158743690
(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[6-(3-prop-1-ynylphenyl)pyrazin-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one
CID 158882526
(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[6-(3-prop-1-ynylphenyl)pyrazin-2-yl]-5H-pyrimidin-4-one;bis((6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one);(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one
CID 161178031
1-[(4-Fluorophenyl)methyl]-5,5-dimethyl-3-[(6-morpholin-4-yl-2-pyridinyl)methylidene]-2-phenylpiperidin-4-one;1-(furan-2-ylmethyl)-5,5-dimethyl-2-phenyl-3-(pyridin-2-ylmethylidene)piperidin-4-one;2-methyl-3-[(6-morpholin-4-yl-2-pyridinyl)methylidene]-2-phenyl-1-(2-thiophen-2-ylethyl)piperidin-4-one
CID 173104782

Frequently Asked Questions

What is the IUPAC name of (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one?
The IUPAC name of (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one (CID 158230216) is (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one.
What is the SMILES notation for (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one?
The canonical SMILES for (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one is C#Cc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.C#Cc1cccc(-c2cccc([C@]3(C)CC(=O)N(C)C(N)=N3)n2)c1.C#Cc1cccc(-c2ccnc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)c1.CC#Cc1cccc(-c2cc([C@]3(C)CC(=O)N(C)C(N)=N3)ccn2)c1.CC#Cc1cccc(-c2coc([C@]3(C)CC(=O)N(C)C(N)=N3)c2)c1.[H]/N=C1/C[C@](C)(c2cc(-c3cncc(C#CC)c3)cs2)C(N2CCOCC2)C(=O)N1C.
What is the InChIKey of (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one?
The InChIKey is GEHCYIJGFPQXTE-SVKZDQQKSA-N. The full InChI is InChI=1S/C23H26N4O2S.C20H20N4O.3C19H18N4O.C19H19N3O2/c1-4-5-16-10-17(14-25-13-16)18-11-19(30-15-18)23(2)12-20(24)26(3)22(28)21(23)27-6-8-29-9-7-27;1-4-6-14-7-5-8-15(11-14)17-12-16(9-10-22-17)20(2)13-18(25)24(3)19(21)23-20;1-4-13-7-5-8-14(11-13)15-9-6-10-16(21-15)19(2)12-17(24)23(3)18(20)22-19;1-4-13-6-5-7-14(10-13)16-11-15(8-9-21-16)19(2)12-17(24)23(3)18(20)22-19;1-4-13-6-5-7-14(10-13)15-8-9-21-16(11-15)19(2)12-17(24)23(3)18(20)22-19;1-4-6-13-7-5-8-14(9-13)15-10-16(24-12-15)19(2)11-17(23)22(3)18(20)21-19/h10-11,13-15,21,24H,6-9,12H2,1-3H3;5,7-12H,13H2,1-3H3,(H2,21,23);3*1,5-11H,12H2,2-3H3,(H2,20,22);5,7-10,12H,11H2,1-3H3,(H2,20,21)/b24-20-;;;;;/t21?,23-;20-;4*19-/m100000/s1.
What are the key properties of (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one?
(6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one has a molecular weight of 2031.48 g/mol, XLogP of 14.57, 13 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-amino-3,6-dimethyl-6-[4-(3-prop-1-ynylphenyl)furan-2-yl]-5H-pyrimidin-4-one;(6S)-2-amino-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one;(6S)-2-amino-6-[2-(3-ethynylphenyl)-4-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[4-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(6S)-2-amino-6-[6-(3-ethynylphenyl)-2-pyridinyl]-3,6-dimethyl-5H-pyrimidin-4-one;(4S)-6-imino-1,4-dimethyl-3-morpholin-4-yl-4-[4-(5-prop-1-ynyl-3-pyridinyl)thiophen-2-yl]piperidin-2-one is sourced from PubChem (CID 158230216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).