2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol

C12H24N2O — CID 124526902

IUPAC2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol
SMILESCN(C1CC1)[C@H]1CCCC[C@H]1NCCO
InChIInChI=1S/C12H24N2O/c1-14(10-6-7-10)12-5-3-2-4-11(12)13-8-9-15/h10-13,15H,2-9H2,1H3/t11-,12+/m1/s1
InChIKeyGJCGLUXVNRWLCS-NEPJUHHUSA-N
MW212.34 g/mol
LogP0.97
Rot. Bonds5

About 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol

2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol (PubChem CID 124526902) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol.

Molecular Properties

Compound Name2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol
PubChem CID124526902
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol
SMILESCN(C1CC1)[C@H]1CCCC[C@H]1NCCO
InChIInChI=1S/C12H24N2O/c1-14(10-6-7-10)12-5-3-2-4-11(12)13-8-9-15/h10-13,15H,2-9H2,1H3/t11-,12+/m1/s1
InChIKeyGJCGLUXVNRWLCS-NEPJUHHUSA-N
XLogP0.97
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol 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

trans-(1S,2S)-2-N-cyclopropyl-1-N-ethyl-2-N-methylcyclohexane-1,2-diamine
CID 134438411
N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]-N-methylacetamide
CID 96554380
2-[[(1S,2S)-2-[methyl(propan-2-yl)amino]cyclohexyl]amino]ethanol
CID 96554725
cis-(1S,2R)-2-N-cyclopropyl-1-N,2-N-dimethylcyclohexane-1,2-diamine
CID 97170112
N-[(1S,2R)-2-(2-hydroxyethylamino)cyclohexyl]-N-propan-2-ylacetamide
CID 96554405
N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide
CID 96553168
2-N-(4-ethylcyclohexyl)-1-N,2-N-dimethylcyclooctane-1,2-diamine
CID 63469418
2-[(2-tert-butylcyclohexyl)amino]ethanol
CID 43085233
trans-(1R,2R)-2-[cyclopropyl(methyl)amino]cyclohexan-1-ol
CID 102731882
2-[[(1R,2S)-2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 131230127
2-[[2-(trifluoromethyl)cyclohexyl]amino]ethanol
CID 64759490
2-N-cyclopentyl-2-N-methyl-4-propan-2-yl-1-N-propylcyclohexane-1,2-diamine
CID 63466974

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol?
The IUPAC name of 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol (CID 124526902) is 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol.
What is the SMILES notation for 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol?
The canonical SMILES for 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol is CN(C1CC1)[C@H]1CCCC[C@H]1NCCO.
What is the InChIKey of 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol?
The InChIKey is GJCGLUXVNRWLCS-NEPJUHHUSA-N. The full InChI is InChI=1S/C12H24N2O/c1-14(10-6-7-10)12-5-3-2-4-11(12)13-8-9-15/h10-13,15H,2-9H2,1H3/t11-,12+/m1/s1.
What are the key properties of 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol?
2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol has a molecular weight of 212.34 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol is sourced from PubChem (CID 124526902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).