2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide

C13H24N2O2 — CID 66004226

IUPAC2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
SMILESNCC1CCCCC1C(=O)NCC1CC(O)C1
InChIInChI=1S/C13H24N2O2/c14-7-10-3-1-2-4-12(10)13(17)15-8-9-5-11(16)6-9/h9-12,16H,1-8,14H2,(H,15,17)
InChIKeyGZPPNHGKBUFIAC-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.64
Rot. Bonds4

About 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide

2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide (PubChem CID 66004226) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
PubChem CID66004226
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
SMILESNCC1CCCCC1C(=O)NCC1CC(O)C1
InChIInChI=1S/C13H24N2O2/c14-7-10-3-1-2-4-12(10)13(17)15-8-9-5-11(16)6-9/h9-12,16H,1-8,14H2,(H,15,17)
InChIKeyGZPPNHGKBUFIAC-UHFFFAOYSA-N
XLogP0.64
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]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

2-[(3-hydroxycyclobutyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 66004477
2-(aminomethyl)-N-(thiolan-3-ylmethyl)cyclohexane-1-carboxamide
CID 107295988
2-(aminomethyl)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexane-1-carboxamide
CID 79363022
2-[(3-hydroxycyclobutyl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103978906
(3-hydroxycyclobutyl)methylurea
CID 66005226
2-(aminomethyl)-N-[2-(cyclopropylmethoxy)ethyl]cyclohexane-1-carboxamide
CID 114097955
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133
3-amino-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
CID 66005543
2-(aminomethyl)-N-[4-(cyclopropylamino)-4-oxobutyl]cyclopentane-1-carboxamide
CID 79401536
3-[[2-(aminomethyl)cyclohexanecarbonyl]amino]-2-hydroxy-2-methylpropanoic acid
CID 66175768
2-(aminomethyl)-N-(3-methylcyclopentyl)cyclohexane-1-carboxamide
CID 114546167
N-[(3-hydroxycyclobutyl)methyl]thiane-2-carboxamide
CID 80595405

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide (CID 66004226) is 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide is NCC1CCCCC1C(=O)NCC1CC(O)C1.
What is the InChIKey of 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide?
The InChIKey is GZPPNHGKBUFIAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c14-7-10-3-1-2-4-12(10)13(17)15-8-9-5-11(16)6-9/h9-12,16H,1-8,14H2,(H,15,17).
What are the key properties of 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide?
2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.64, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 66004226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).