[4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol

C14H18N4O — CID 164640056

IUPAC[4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol
SMILESOCc1cnccc1N1CCC[C@H](n2ccnc2)C1
InChIInChI=1S/C14H18N4O/c19-10-12-8-15-4-3-14(12)17-6-1-2-13(9-17)18-7-5-16-11-18/h3-5,7-8,11,13,19H,1-2,6,9-10H2/t13-/m0/s1
InChIKeyOCGORJPSYYRILW-ZDUSSCGKSA-N
MW258.32 g/mol
LogP1.61
Rot. Bonds3

About [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol

[4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol (PubChem CID 164640056) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol
PubChem CID164640056
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name[4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol
SMILESOCc1cnccc1N1CCC[C@H](n2ccnc2)C1
InChIInChI=1S/C14H18N4O/c19-10-12-8-15-4-3-14(12)17-6-1-2-13(9-17)18-7-5-16-11-18/h3-5,7-8,11,13,19H,1-2,6,9-10H2/t13-/m0/s1
InChIKeyOCGORJPSYYRILW-ZDUSSCGKSA-N
XLogP1.61
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

{3-Fluoro-4-[4-(pyrimidin-2-yl)piperazin-1-yl]phenyl}methanol
CID 28945688
Imidazo[1,2-a]pyridin-6-ylmethanol
CID 7060530
2-(1-(3-methyl-2-buten-1-yl)-4-{[1-(2-pyrimidinyl)-1H-pyrrol-2-yl]methyl}-2-piperazinyl)ethanol
CID 16190757
2-(1-benzyl-4-{[1-(2-pyrimidinyl)-1H-pyrrol-2-yl]methyl}-2-piperazinyl)ethanol
CID 16188998
{Imidazo[1,5-a]pyridin-6-yl}methanol
CID 58373994
1'-[5-(1H-imidazol-1-ylmethyl)-2-pyridinyl]-1,4'-bipiperidin-4-ol
CID 70729000
[1-(3-Pyridin-3-ylpyrazin-2-yl)pyrrolidin-2-yl]methanol
CID 172433444
[1-(6-Pyridin-3-ylpyrazin-2-yl)pyrrolidin-2-yl]methanol
CID 172435940
(Imidazo(1,2-a)pyridin-6-yl)methanol hydrochloride
CID 71748611
1-[4-(1H-imidazol-1-yl)benzyl]-4-pyridin-3-ylpiperidin-4-ol
CID 77092443
[(3S)-1-[2-[5-(5-ethyl-2-pyridinyl)-4-phenylimidazol-1-yl]ethyl]piperidin-3-yl]methanol
CID 95147482
(1R)-2-[2-(1-methylimidazol-2-yl)imidazol-1-yl]-1-pyridin-3-ylethanol
CID 97124930

Frequently Asked Questions

What is the IUPAC name of [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol?
The IUPAC name of [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol (CID 164640056) is [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol.
What is the SMILES notation for [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol?
The canonical SMILES for [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol is OCc1cnccc1N1CCC[C@H](n2ccnc2)C1.
What is the InChIKey of [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol?
The InChIKey is OCGORJPSYYRILW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H18N4O/c19-10-12-8-15-4-3-14(12)17-6-1-2-13(9-17)18-7-5-16-11-18/h3-5,7-8,11,13,19H,1-2,6,9-10H2/t13-/m0/s1.
What are the key properties of [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol?
[4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol has a molecular weight of 258.32 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3S)-3-imidazol-1-ylpiperidin-1-yl]-3-pyridinyl]methanol is sourced from PubChem (CID 164640056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).