6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide

C12H24N2O2 — CID 107221663

IUPAC6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide
SMILESNCCCCCC(=O)N[C@H]1CCCC[C@@H]1O
InChIInChI=1S/C12H24N2O2/c13-9-5-1-2-8-12(16)14-10-6-3-4-7-11(10)15/h10-11,15H,1-9,13H2,(H,14,16)/t10-,11-/m0/s1
InChIKeyOMTKCJPBODJXGF-QWRGUYRKSA-N
MW228.34 g/mol
LogP0.93
Rot. Bonds6

About 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide

6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide (PubChem CID 107221663) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide
PubChem CID107221663
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide
SMILESNCCCCCC(=O)N[C@H]1CCCC[C@@H]1O
InChIInChI=1S/C12H24N2O2/c13-9-5-1-2-8-12(16)14-10-6-3-4-7-11(10)15/h10-11,15H,1-9,13H2,(H,14,16)/t10-,11-/m0/s1
InChIKeyOMTKCJPBODJXGF-QWRGUYRKSA-N
XLogP0.93
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide 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-[(1R,2S)-2-hydroxycyclohexyl]-N'-[(1S,2R)-2-hydroxycyclohexyl]hexanediamide
CID 40600214
5-hydroxy-N-(2-hydroxycyclohexyl)pentanamide
CID 79199015
6-amino-N-[2-(trifluoromethyl)cyclohexyl]hexanamide
CID 43712731
4-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]butanamide
CID 107216783
methyl 5-[[(1R,2R)-2-hydroxycyclohexyl]amino]-5-oxopentanoate
CID 10900833
2-(4-aminobutanoylamino)cyclohexane-1-carboxamide
CID 119334193
4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide
CID 107221714
7-amino-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)heptanamide
CID 43705615
2-hydroxy-N-[(1R,2R)-2-hydroxycycloheptyl]acetamide
CID 130693023
N-(2-hydroxycyclopentyl)butanamide
CID 72951810
N-[2-(dodecanoylamino)cyclohexyl]dodecanamide
CID 10299379
2-(4-aminobutanoylamino)cyclopentane-1-carboxylic acid
CID 64814362

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide?
The IUPAC name of 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide (CID 107221663) is 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide.
What is the SMILES notation for 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide?
The canonical SMILES for 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide is NCCCCCC(=O)N[C@H]1CCCC[C@@H]1O.
What is the InChIKey of 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide?
The InChIKey is OMTKCJPBODJXGF-QWRGUYRKSA-N. The full InChI is InChI=1S/C12H24N2O2/c13-9-5-1-2-8-12(16)14-10-6-3-4-7-11(10)15/h10-11,15H,1-9,13H2,(H,14,16)/t10-,11-/m0/s1.
What are the key properties of 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide?
6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide has a molecular weight of 228.34 g/mol, XLogP of 0.93, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(1S,2S)-2-hydroxycyclohexyl]hexanamide is sourced from PubChem (CID 107221663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).