5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine

C110H186FN17O2 — CID 157392766

IUPAC5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine
SMILESC.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N)cn1.CC(C)c1ccc(N)nc1.CC(C)c1ccc(O)cn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1ccncn1.CC(C)c1cncnc1.CC(C)c1ncccn1.CCCCCc1ccc(C(C)C)nc1.COc1ccc(C(C)C)nc1
InChIInChI=1S/C13H21N.C9H13NO.C8H10FN.2C8H12N2.C8H11NO.3C8H11N.3C7H10N2.11CH4/c1-4-5-6-7-12-8-9-13(11(2)3)14-10-12;1-7(2)9-5-4-8(11-3)6-10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-6(2)7-3-4-8(9)10-5-7;1-6(2)8-4-3-7(10)5-9-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;;;;;;;;;;;/h8-11H,4-7H2,1-3H3;4-7H,1-3H3;3-6H,1-2H3;3-6H,9H2,1-2H3;3-6H,1-2H3,(H2,9,10);3-6,10H,1-2H3;3*3-7H,1-2H3;3*3-6H,1-2H3;11*1H4
InChIKeyBMEWWWIUOSARRL-UHFFFAOYSA-N
MW1797.81 g/mol
LogP32.39
Rot. Bonds17

About 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine

5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine (PubChem CID 157392766) has the molecular formula C110H186FN17O2 and a molecular weight of 1797.81 g/mol. Its IUPAC name is 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine.

Molecular Properties

Compound Name5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine
PubChem CID157392766
Molecular FormulaC110H186FN17O2
Molecular Weight1797.81 g/mol
Exact Mass1796.50
IUPAC Name5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine
SMILESC.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N)cn1.CC(C)c1ccc(N)nc1.CC(C)c1ccc(O)cn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1ccncn1.CC(C)c1cncnc1.CC(C)c1ncccn1.CCCCCc1ccc(C(C)C)nc1.COc1ccc(C(C)C)nc1
InChIInChI=1S/C13H21N.C9H13NO.C8H10FN.2C8H12N2.C8H11NO.3C8H11N.3C7H10N2.11CH4/c1-4-5-6-7-12-8-9-13(11(2)3)14-10-12;1-7(2)9-5-4-8(11-3)6-10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-6(2)7-3-4-8(9)10-5-7;1-6(2)8-4-3-7(10)5-9-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;;;;;;;;;;;/h8-11H,4-7H2,1-3H3;4-7H,1-3H3;3-6H,1-2H3;3-6H,9H2,1-2H3;3-6H,1-2H3,(H2,9,10);3-6,10H,1-2H3;3*3-7H,1-2H3;3*3-6H,1-2H3;11*1H4
InChIKeyBMEWWWIUOSARRL-UHFFFAOYSA-N
XLogP32.39
TPSA274.85 Ų
H-Bond Donors3
H-Bond Acceptors19
Rotatable Bonds17
Heavy Atoms130
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001797.81
LogP ≤ 532.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

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

Analyze 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(6-(6-Methoxypyridin-3-ylamino)-2-morpholinopyrimidin-4-yl)phenol
CID 50908894
5-(4-Amino-6-methyl-1,3,5-triazin-2-YL)-N-(6-methoxypyridin-3-YL)-6'-methyl-3,3'-bipyridin-6-amine
CID 59548274
4-[1-[6-(5-Methoxy-3-pyridinyl)-2-pyridin-4-ylpyrimidin-4-yl]piperidin-4-yl]morpholine
CID 155540693
N-[5-[4-(dimethylamino)piperidin-1-yl]-2-pyridinyl]-4-morpholin-4-yl-2-pyridin-3-yloxypyrido[3,4-d]pyrimidin-6-amine
CID 141494018
4-[6-[(6-Methoxy-3-pyridinyl)amino][2,3'-bipyridin]-5-yl]-6-methyl-1,3,5-triazin-2-amine
CID 49785438
5-(4-Amino-6-methyl-1,3,5-triazin-2-YL)-5'-fluoro-N-(6-methoxypyridin-3-YL)-3,3'-bipyridin-6-amine
CID 49785439
4-[6'-[(6-Methoxy-3-pyridinyl)amino][2,3'-bipyridin]-5'-yl]-6-methyl-1,3,5-triazin-2-amine
CID 59548178
4-[6'-Methoxy-6-[(6-methoxy-3-pyridinyl)amino][3,3'-bipyridin]-5-yl]-6-methyl-1,3,5-triazin-2-amine
CID 59548229
6-[2-[(5-fluoro-6-methoxy-3-pyridinyl)amino]-5-[(1S)-1-morpholin-4-ylethyl]-3-pyridinyl]-2-methylpyrimidin-4-amine
CID 59548271
6-[2-[(5-fluoro-6-methoxy-3-pyridinyl)amino]-5-[(1R)-1-morpholin-4-ylethyl]-3-pyridinyl]-2-methylpyrimidin-4-amine
CID 59548330
2-(5-(6-Amino-2-methylpyrimidin-4-yl)-6-(5-fluoro-6-methoxypyridin-3-ylamino)pyridin-3-yl)propan-2-ol
CID 59548339
5-(4-Amino-6-methyl-1,3,5-triazin-2-YL)-N-(5-fluoro-6-methoxypyridin-3-YL)-2,3'-bipyridin-6-amine
CID 59548385

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine?
The IUPAC name of 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine (CID 157392766) is 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine.
What is the SMILES notation for 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine?
The canonical SMILES for 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine is C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N)cn1.CC(C)c1ccc(N)nc1.CC(C)c1ccc(O)cn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1ccncn1.CC(C)c1cncnc1.CC(C)c1ncccn1.CCCCCc1ccc(C(C)C)nc1.COc1ccc(C(C)C)nc1.
What is the InChIKey of 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine?
The InChIKey is BMEWWWIUOSARRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N.C9H13NO.C8H10FN.2C8H12N2.C8H11NO.3C8H11N.3C7H10N2.11CH4/c1-4-5-6-7-12-8-9-13(11(2)3)14-10-12;1-7(2)9-5-4-8(11-3)6-10-9;2*1-6(2)8-4-3-7(9)5-10-8;1-6(2)7-3-4-8(9)10-5-7;1-6(2)8-4-3-7(10)5-9-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;;;;;;;;;;;/h8-11H,4-7H2,1-3H3;4-7H,1-3H3;3-6H,1-2H3;3-6H,9H2,1-2H3;3-6H,1-2H3,(H2,9,10);3-6,10H,1-2H3;3*3-7H,1-2H3;3*3-6H,1-2H3;11*1H4.
What are the key properties of 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine?
5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine has a molecular weight of 1797.81 g/mol, XLogP of 32.39, 17 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-propan-2-ylpyridine;methane;5-methoxy-2-propan-2-ylpyridine;5-pentyl-2-propan-2-ylpyridine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-3-amine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-ylpyridin-3-ol;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine is sourced from PubChem (CID 157392766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).