cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone

C19H24N4O — CID 95838424

IUPACcyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCC[C@@H](c2cccc(-n3ccnc3)n2)C1
InChIInChI=1S/C19H24N4O/c24-19(15-5-1-2-6-15)22-11-4-7-16(13-22)17-8-3-9-18(21-17)23-12-10-20-14-23/h3,8-10,12,14-16H,1-2,4-7,11,13H2/t16-/m1/s1
InChIKeyCQZHVRLOKMSMCW-MRXNPFEDSA-N
MW324.43 g/mol
LogP3.16
Rot. Bonds3

About cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone

cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone (PubChem CID 95838424) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone
PubChem CID95838424
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Namecyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCC[C@@H](c2cccc(-n3ccnc3)n2)C1
InChIInChI=1S/C19H24N4O/c24-19(15-5-1-2-6-15)22-11-4-7-16(13-22)17-8-3-9-18(21-17)23-12-10-20-14-23/h3,8-10,12,14-16H,1-2,4-7,11,13H2/t16-/m1/s1
InChIKeyCQZHVRLOKMSMCW-MRXNPFEDSA-N
XLogP3.16
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]-2-phenylethanone
CID 110267731
[(3S)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 95838490
2-[(3S)-1-cyclohexylpiperidin-3-yl]-6-imidazol-1-ylpyridine
CID 95838629
2-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]-4,6-dimethylpyrimidine
CID 95829311
2-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]-6-imidazol-1-ylpyridine
CID 95838563
cyclopentyl-[3-[6-(2-methylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]methanone
CID 110253502
[(3R)-3-(2-aminopyrimidin-4-yl)piperidin-1-yl]-cyclobutylmethanone
CID 124940557
cyclobutyl-[3-(2-methylpyrimidin-4-yl)piperidin-1-yl]methanone
CID 110253739
[(3S)-3-(2-aminopyrimidin-4-yl)piperidin-1-yl]-cyclobutylmethanone
CID 124940558
1-[(3S)-3-(6-imidazol-1-ylpyrazin-2-yl)piperidin-1-yl]-2-pyridin-3-ylethanone
CID 95815681
[3-(6-benzyl-2-pyridinyl)piperidin-1-yl]-cyclobutylmethanone
CID 110249571
cyclopentyl-[(3S)-3-[2-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]methanone
CID 95093558

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone?
The IUPAC name of cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone (CID 95838424) is cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone is O=C(C1CCCC1)N1CCC[C@@H](c2cccc(-n3ccnc3)n2)C1.
What is the InChIKey of cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone?
The InChIKey is CQZHVRLOKMSMCW-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H24N4O/c24-19(15-5-1-2-6-15)22-11-4-7-16(13-22)17-8-3-9-18(21-17)23-12-10-20-14-23/h3,8-10,12,14-16H,1-2,4-7,11,13H2/t16-/m1/s1.
What are the key properties of cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone?
cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone has a molecular weight of 324.43 g/mol, XLogP of 3.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]methanone is sourced from PubChem (CID 95838424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).