2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide

C15H28N2O2 — CID 102861598

IUPAC2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide
SMILESNCC1CCCCC1C(=O)N(CCCO)C1CCC1
InChIInChI=1S/C15H28N2O2/c16-11-12-5-1-2-8-14(12)15(19)17(9-4-10-18)13-6-3-7-13/h12-14,18H,1-11,16H2
InChIKeyMSLOTJDOOZUMJP-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.51
Rot. Bonds6

About 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide

2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide (PubChem CID 102861598) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide
PubChem CID102861598
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide
SMILESNCC1CCCCC1C(=O)N(CCCO)C1CCC1
InChIInChI=1S/C15H28N2O2/c16-11-12-5-1-2-8-14(12)15(19)17(9-4-10-18)13-6-3-7-13/h12-14,18H,1-11,16H2
InChIKeyMSLOTJDOOZUMJP-UHFFFAOYSA-N
XLogP1.51
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-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

N-cyclobutyl-N-(3-hydroxypropyl)cyclooctanecarboxamide
CID 102866891
3-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide
CID 102871203
2-[cyclohexyl(2-hydroxyethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978364
2-[cyclobutyl(2-hydroxyethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 102860862
N-(3-aminopropyl)-N-cyclobutyl-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 102873908
2-[cyclobutyl(3-hydroxypropyl)carbamoyl]-4-ethylcyclopentane-1-carboxylic acid
CID 102860789
N-cyclobutyl-N-(3-hydroxypropyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 102978249
5-amino-N-cyclobutyl-N-(3-hydroxypropyl)pentanamide
CID 102861717
N-cyclobutyl-N-(3-hydroxypropyl)-2-phenylcyclopropane-1-carboxamide
CID 102866442
2-(aminomethyl)-N-(5-hydroxypentyl)cyclopentane-1-carboxamide
CID 107317629
2-(aminomethyl)-N-methyl-N-pent-4-enylcyclopentane-1-carboxamide
CID 115747690
N-(3-aminopropyl)-N-cyclohexylcycloheptanecarboxamide
CID 62586831

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide (CID 102861598) is 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide is NCC1CCCCC1C(=O)N(CCCO)C1CCC1.
What is the InChIKey of 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide?
The InChIKey is MSLOTJDOOZUMJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c16-11-12-5-1-2-8-14(12)15(19)17(9-4-10-18)13-6-3-7-13/h12-14,18H,1-11,16H2.
What are the key properties of 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide?
2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 102861598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).