cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol

C13H25NO — CID 51614343

IUPACcis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol
SMILESO[C@H]1CCCC[C@H]1NCC1CCCCC1
InChIInChI=1S/C13H25NO/c15-13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h11-15H,1-10H2/t12-,13+/m1/s1
InChIKeyJQUDVRAZYAVUPF-OLZOCXBDSA-N
MW211.35 g/mol
LogP2.46
Rot. Bonds3

About cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol

cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol (PubChem CID 51614343) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol
PubChem CID51614343
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Namecis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol
SMILESO[C@H]1CCCC[C@H]1NCC1CCCCC1
InChIInChI=1S/C13H25NO/c15-13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h11-15H,1-10H2/t12-,13+/m1/s1
InChIKeyJQUDVRAZYAVUPF-OLZOCXBDSA-N
XLogP2.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol 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-(cyclohexylmethylamino)cyclohexan-1-ol
CID 11615431
trans-(1S,2S)-2-(cyclopentylmethylamino)cyclopentan-1-ol
CID 93345953
trans-(1S,2S)-2-(cyclobutylmethylamino)cyclohexan-1-ol
CID 93346202
cis-(1R,2S)-2-(cyclopropylmethylamino)cyclohexan-1-ol
CID 58627713
2-[(4-methylcyclohexyl)methylamino]cyclohexan-1-ol
CID 63243394
3-[[[(1S,2S)-2-hydroxycyclopentyl]amino]methyl]cyclohexan-1-ol
CID 106132527
cis-(1R,2S)-2-[[(1S)-cyclohex-3-en-1-yl]methylamino]cyclohexan-1-ol
CID 124673828
trans-(1R,2R)-2-(cyclohex-3-en-1-ylmethylamino)cyclohexan-1-ol
CID 104923298
2-(thiolan-3-ylmethylamino)cyclohexan-1-ol
CID 107132036
trans-(1R,2R)-2-(1,4-dioxaspiro[4.5]decan-8-ylmethylamino)cyclohexan-1-ol
CID 154755007
trans-(1S,2S)-2-[2-[[(1R,2S)-2-hydroxycyclohexyl]amino]ethylamino]cyclohexan-1-ol
CID 92759264
N-(cyclopropylmethyl)-2-[(2-hydroxycycloheptyl)amino]acetamide
CID 113394731

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol?
The IUPAC name of cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol (CID 51614343) is cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol.
What is the SMILES notation for cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol?
The canonical SMILES for cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol is O[C@H]1CCCC[C@H]1NCC1CCCCC1.
What is the InChIKey of cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol?
The InChIKey is JQUDVRAZYAVUPF-OLZOCXBDSA-N. The full InChI is InChI=1S/C13H25NO/c15-13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h11-15H,1-10H2/t12-,13+/m1/s1.
What are the key properties of cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol?
cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol has a molecular weight of 211.35 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol is sourced from PubChem (CID 51614343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).