N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide

C14H26N2O2 — CID 106124949

IUPACN-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCC2CCCC(O)C2)C1
InChIInChI=1S/C14H26N2O2/c1-11-4-3-7-16(10-11)14(18)15-9-12-5-2-6-13(17)8-12/h11-13,17H,2-10H2,1H3,(H,15,18)
InChIKeyDIHUVRPQBBGSFA-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.98
Rot. Bonds2

About N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide

N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide (PubChem CID 106124949) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide
PubChem CID106124949
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCC2CCCC(O)C2)C1
InChIInChI=1S/C14H26N2O2/c1-11-4-3-7-16(10-11)14(18)15-9-12-5-2-6-13(17)8-12/h11-13,17H,2-10H2,1H3,(H,15,18)
InChIKeyDIHUVRPQBBGSFA-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

Analyze N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]piperidine-1-carboxamide
CID 116654402
1-[(3-hydroxycyclohexyl)methyl]-3-[2-(3-methylpiperidin-1-yl)ethyl]urea
CID 111504652
3-(hydroxymethyl)-N-[(3-methylcyclohexyl)methyl]pyrrolidine-1-carboxamide
CID 111443830
3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide
CID 115629689
4-[[(3-methylpiperidine-1-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79525817
N-[[3-[(pyrrolidine-1-carbonylamino)methyl]cyclohexyl]methyl]pyrrolidine-1-carboxamide
CID 43834019
3-methyl-N-(thiolan-3-ylmethyl)piperidine-1-carboxamide
CID 107295549
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
2-[1-[(4-methylcyclohexyl)methylcarbamoyl]piperidin-3-yl]acetic acid
CID 63244628
N-[(3-methylcyclohexyl)methyl]-3-(4-methylpyrazol-1-yl)piperidine-1-carboxamide
CID 166202868
3-hydroxy-N-[2-(3-methylpiperidin-1-yl)ethyl]piperidine-1-carboxamide
CID 110896167
N-[(1-benzylpiperidin-3-yl)methyl]-3-methylpiperidine-1-carboxamide
CID 60597786

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide (CID 106124949) is N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide is CC1CCCN(C(=O)NCC2CCCC(O)C2)C1.
What is the InChIKey of N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide?
The InChIKey is DIHUVRPQBBGSFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11-4-3-7-16(10-11)14(18)15-9-12-5-2-6-13(17)8-12/h11-13,17H,2-10H2,1H3,(H,15,18).
What are the key properties of N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide?
N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-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 N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide is sourced from PubChem (CID 106124949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).