4-(2-hydroxybutylamino)cyclohexane-1-carboxamide

C11H22N2O2 — CID 61042883

IUPAC4-(2-hydroxybutylamino)cyclohexane-1-carboxamide
SMILESCCC(O)CNC1CCC(C(N)=O)CC1
InChIInChI=1S/C11H22N2O2/c1-2-10(14)7-13-9-5-3-8(4-6-9)11(12)15/h8-10,13-14H,2-7H2,1H3,(H2,12,15)
InChIKeyJSJOWQSJPFXJGA-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.39
Rot. Bonds5

About 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide

4-(2-hydroxybutylamino)cyclohexane-1-carboxamide (PubChem CID 61042883) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-(2-hydroxybutylamino)cyclohexane-1-carboxamide
PubChem CID61042883
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name4-(2-hydroxybutylamino)cyclohexane-1-carboxamide
SMILESCCC(O)CNC1CCC(C(N)=O)CC1
InChIInChI=1S/C11H22N2O2/c1-2-10(14)7-13-9-5-3-8(4-6-9)11(12)15/h8-10,13-14H,2-7H2,1H3,(H2,12,15)
InChIKeyJSJOWQSJPFXJGA-UHFFFAOYSA-N
XLogP0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(2-hydroxybutylamino)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

4-[[2-hydroxy-3-(2-methylpropoxy)propyl]amino]cyclohexane-1-carboxamide
CID 54913944
3-[(4-carbamoylcyclohexyl)amino]-2-methylpropanoic acid
CID 61044220
1-(cyclobutylamino)butan-2-ol
CID 62416322
4-[(3-cyclohexyloxy-2-hydroxypropyl)amino]cyclohexane-1-carboxamide
CID 61044585
4-(2-cyanopropylamino)cyclohexane-1-carboxamide
CID 61043742
3-(2-ethylbutylamino)cyclohexane-1-carboxamide
CID 115756932
4-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]cyclohexane-1-carboxamide
CID 61043138
1-(2-hydroxybutyl)piperidine-4-carboxamide
CID 62198498
4-(2-bromobutanoylamino)cyclohexane-1-carboxamide
CID 62854482
4-(2-phenylpropylamino)cyclohexane-1-carboxamide
CID 43748733
4-[(3-ethoxy-2-hydroxypropyl)amino]cyclohexane-1-carboxylic acid
CID 63931576
cyclopropanecarboxamide;propanamide
CID 174752815

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide?
The IUPAC name of 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide (CID 61042883) is 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide?
The canonical SMILES for 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide is CCC(O)CNC1CCC(C(N)=O)CC1.
What is the InChIKey of 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide?
The InChIKey is JSJOWQSJPFXJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-2-10(14)7-13-9-5-3-8(4-6-9)11(12)15/h8-10,13-14H,2-7H2,1H3,(H2,12,15).
What are the key properties of 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide?
4-(2-hydroxybutylamino)cyclohexane-1-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxybutylamino)cyclohexane-1-carboxamide is sourced from PubChem (CID 61042883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).