2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide

C18H27N3O2 — CID 111331870

IUPAC2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
SMILESO=C(CC1(O)CCCCC1)NC1CCN(c2ccccn2)CC1
InChIInChI=1S/C18H27N3O2/c22-17(14-18(23)9-3-1-4-10-18)20-15-7-12-21(13-8-15)16-6-2-5-11-19-16/h2,5-6,11,15,23H,1,3-4,7-10,12-14H2,(H,20,22)
InChIKeyVQNDRCODWSDIMR-UHFFFAOYSA-N
MW317.43 g/mol
LogP2.25
Rot. Bonds4

About 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide

2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide (PubChem CID 111331870) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
PubChem CID111331870
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
SMILESO=C(CC1(O)CCCCC1)NC1CCN(c2ccccn2)CC1
InChIInChI=1S/C18H27N3O2/c22-17(14-18(23)9-3-1-4-10-18)20-15-7-12-21(13-8-15)16-6-2-5-11-19-16/h2,5-6,11,15,23H,1,3-4,7-10,12-14H2,(H,20,22)
InChIKeyVQNDRCODWSDIMR-UHFFFAOYSA-N
XLogP2.25
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-hydroxycyclohexyl)-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]acetamide
CID 97241202
3-oxo-N-(1-pyridin-2-ylpiperidin-4-yl)butanamide
CID 61250819
3-cyclohexyl-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621185
N-cycloheptyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4884816
2-(cyclopropylmethylamino)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 60867246
5-amino-4-methyl-N-(1-pyridin-2-ylpiperidin-4-yl)pentanamide
CID 82013435
2,2-difluoro-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 103514862
1-[(2-hydroxy-1-methylcyclohexyl)methyl]-3-(1-pyridin-2-ylpiperidin-4-yl)urea
CID 111722313
3-amino-4-oxo-4-[(1-pyridin-2-ylpiperidin-4-yl)amino]butanoic acid
CID 64895091
1-(2-methylcyclopentyl)-3-(1-pyridin-2-ylpiperidin-4-yl)urea
CID 56826840
2-(5-amino-2-pyridinyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide;dihydrochloride
CID 120643499
2-(2,5-dimethoxyphenyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 78876192

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide (CID 111331870) is 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide is O=C(CC1(O)CCCCC1)NC1CCN(c2ccccn2)CC1.
What is the InChIKey of 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide?
The InChIKey is VQNDRCODWSDIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c22-17(14-18(23)9-3-1-4-10-18)20-15-7-12-21(13-8-15)16-6-2-5-11-19-16/h2,5-6,11,15,23H,1,3-4,7-10,12-14H2,(H,20,22).
What are the key properties of 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide?
2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide has a molecular weight of 317.43 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclohexyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide is sourced from PubChem (CID 111331870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).