[4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol

C16H22N4O — CID 136568930

IUPAC[4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol
SMILESCCc1nccn1C1CCCN(c2ccncc2CO)C1
InChIInChI=1S/C16H22N4O/c1-2-16-18-7-9-20(16)14-4-3-8-19(11-14)15-5-6-17-10-13(15)12-21/h5-7,9-10,14,21H,2-4,8,11-12H2,1H3
InChIKeyHBNWXNCEMJOVBD-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.17
Rot. Bonds4

About [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol

[4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol (PubChem CID 136568930) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol
PubChem CID136568930
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name[4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol
SMILESCCc1nccn1C1CCCN(c2ccncc2CO)C1
InChIInChI=1S/C16H22N4O/c1-2-16-18-7-9-20(16)14-4-3-8-19(11-14)15-5-6-17-10-13(15)12-21/h5-7,9-10,14,21H,2-4,8,11-12H2,1H3
InChIKeyHBNWXNCEMJOVBD-UHFFFAOYSA-N
XLogP2.17
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]pyridine-3-carboxylic acid
CID 167865024
4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]pyridine-3-carboxamide
CID 133470476
4-[(3R)-3-(2-ethylimidazol-1-yl)piperidin-1-yl]-6-pyrrolidin-1-ylpyrimidine
CID 124883297
[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]methanol
CID 81236983
4-acetyl-3-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]benzonitrile
CID 133457766
4-ethyl-6-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-2-pyridin-4-ylpyrimidine
CID 133295037
N-[[4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-3-pyridinyl]methyl]ethanamine
CID 81247402
4-(2-ethylimidazol-1-yl)-1-methylazepane
CID 84734196
2-amino-1-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]ethanone;dihydrochloride
CID 119881391
1-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-2-(methylamino)ethanone;hydrochloride
CID 120704387
3-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-5-phenyl-1,2,4-oxadiazole
CID 133482995
2-[1-[3-(hydroxymethyl)-4-pyridinyl]pyrrolidin-3-yl]ethanol
CID 114799569

Frequently Asked Questions

What is the IUPAC name of [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol?
The IUPAC name of [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol (CID 136568930) is [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol.
What is the SMILES notation for [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol?
The canonical SMILES for [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol is CCc1nccn1C1CCCN(c2ccncc2CO)C1.
What is the InChIKey of [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol?
The InChIKey is HBNWXNCEMJOVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-2-16-18-7-9-20(16)14-4-3-8-19(11-14)15-5-6-17-10-13(15)12-21/h5-7,9-10,14,21H,2-4,8,11-12H2,1H3.
What are the key properties of [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol?
[4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol has a molecular weight of 286.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]-3-pyridinyl]methanol is sourced from PubChem (CID 136568930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).