3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide

C14H26N2O2 — CID 110894815

IUPAC3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
SMILESCC1CCC(NC(=O)N2CCCC(CO)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-11-4-6-13(7-5-11)15-14(18)16-8-2-3-12(9-16)10-17/h11-13,17H,2-10H2,1H3,(H,15,18)
InChIKeyGPZVNFJITDBFBE-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.98
Rot. Bonds2

About 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide

3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide (PubChem CID 110894815) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
PubChem CID110894815
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
SMILESCC1CCC(NC(=O)N2CCCC(CO)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-11-4-6-13(7-5-11)15-14(18)16-8-2-3-12(9-16)10-17/h11-13,17H,2-10H2,1H3,(H,15,18)
InChIKeyGPZVNFJITDBFBE-UHFFFAOYSA-N
XLogP1.98
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-cyclooctyl-3-(hydroxymethyl)piperidine-1-carboxamide
CID 95577956
3-(hydroxymethyl)-N-(1-propylpiperidin-4-yl)piperidine-1-carboxamide
CID 111508115
3-(hydroxymethyl)-N-(2-methylcyclohexyl)piperidine-1-carboxamide
CID 110882587
3-(hydroxymethyl)-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)piperidine-1-carboxamide
CID 111508645
2-[1-[(3-methylcyclobutyl)carbamoyl]piperidin-3-yl]acetic acid
CID 113467402
N-[1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-(hydroxymethyl)piperidine-1-carboxamide
CID 71867658
2-[1-[(3,4-dimethylcyclohexyl)carbamoyl]piperidin-3-yl]acetic acid
CID 64742546
N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide
CID 146083111
2-[[3-(hydroxymethyl)piperidine-1-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 64815349
2-[1-(cyclohexylcarbamoyl)piperidin-3-yl]acetic acid
CID 62690079
3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 51083495
N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
CID 60600680

Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
The IUPAC name of 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide (CID 110894815) is 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
The canonical SMILES for 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide is CC1CCC(NC(=O)N2CCCC(CO)C2)CC1.
What is the InChIKey of 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
The InChIKey is GPZVNFJITDBFBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11-4-6-13(7-5-11)15-14(18)16-8-2-3-12(9-16)10-17/h11-13,17H,2-10H2,1H3,(H,15,18).
What are the key properties of 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide is sourced from PubChem (CID 110894815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).