N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide

C14H25NO2 — CID 115151230

IUPACN-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide
SMILESCN(CC1CCC1)C(=O)C1CCC(CO)CC1
InChIInChI=1S/C14H25NO2/c1-15(9-11-3-2-4-11)14(17)13-7-5-12(10-16)6-8-13/h11-13,16H,2-10H2,1H3
InChIKeyZHMWQYGGFDGFFI-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.04
Rot. Bonds4

About N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide

N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide (PubChem CID 115151230) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide
PubChem CID115151230
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC NameN-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide
SMILESCN(CC1CCC1)C(=O)C1CCC(CO)CC1
InChIInChI=1S/C14H25NO2/c1-15(9-11-3-2-4-11)14(17)13-7-5-12(10-16)6-8-13/h11-13,16H,2-10H2,1H3
InChIKeyZHMWQYGGFDGFFI-UHFFFAOYSA-N
XLogP2.04
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopentylmethyl)-4-(2-hydroxyethyl)-N-methylcyclohexane-1-carboxamide
CID 115151025
1-N,4-N-bis(cyclohexylmethyl)-1-N,4-N-dimethylcyclohexane-1,4-dicarboxamide
CID 112814425
4-[cyclopentylmethyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63783865
4-tert-butyl-N-methyl-N-(piperidin-4-ylmethyl)cyclohexane-1-carboxamide
CID 79700426
N-methyl-N-(oxan-4-ylmethyl)cyclohexanecarboxamide
CID 110752395
9-amino-N-(cyclobutylmethyl)-N-methylbicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120989590
4-(aminomethyl)-N-(cyclopentylmethyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide
CID 115151536
1-(cyclobutylmethyl)-1-methylurea
CID 62860439
4-amino-4-cyano-N-(cyclopentylmethyl)-N-methylcyclohexane-1-carboxamide
CID 115151311
N-methyl-N-[(1-methylpiperidin-3-yl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 119855559
N-(cyclobutylmethyl)-N-methylpyrrolidine-1-carboxamide
CID 115621970
(2S,4S)-N-(cyclopentylmethyl)-N,2-dimethylpiperidine-4-carboxamide;hydrochloride
CID 120628237

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide (CID 115151230) is N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide is CN(CC1CCC1)C(=O)C1CCC(CO)CC1.
What is the InChIKey of N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide?
The InChIKey is ZHMWQYGGFDGFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-15(9-11-3-2-4-11)14(17)13-7-5-12(10-16)6-8-13/h11-13,16H,2-10H2,1H3.
What are the key properties of N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide?
N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-4-(hydroxymethyl)-N-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 115151230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).