(1R)-2-(benzylamino)cyclohexan-1-ol

C13H19NO — CID 67149916

IUPAC(1R)-2-(benzylamino)cyclohexan-1-ol
SMILESO[C@@H]1CCCCC1NCc1ccccc1
InChIInChI=1S/C13H19NO/c15-13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h1-3,6-7,12-15H,4-5,8-10H2/t12?,13-/m1/s1
InChIKeyNJNCYFUGUYIMEQ-ZGTCLIOFSA-N
MW205.30 g/mol
LogP2.08
Rot. Bonds3

About (1R)-2-(benzylamino)cyclohexan-1-ol

(1R)-2-(benzylamino)cyclohexan-1-ol (PubChem CID 67149916) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (1R)-2-(benzylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name(1R)-2-(benzylamino)cyclohexan-1-ol
PubChem CID67149916
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(1R)-2-(benzylamino)cyclohexan-1-ol
SMILESO[C@@H]1CCCCC1NCc1ccccc1
InChIInChI=1S/C13H19NO/c15-13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h1-3,6-7,12-15H,4-5,8-10H2/t12?,13-/m1/s1
InChIKeyNJNCYFUGUYIMEQ-ZGTCLIOFSA-N
XLogP2.08
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,2R)-2-(benzylamino)cyclooctan-1-ol
CID 129411683
(2R)-2-hydroxy-2-phenylacetic acid;trans-(1S,2S)-2-(benzylamino)cyclohexan-1-ol
CID 11610127
2-[(4-ethylphenyl)methylamino]cyclohexan-1-ol
CID 60612614
2-[(4-methylphenyl)methylamino]cyclohexan-1-ol
CID 60714627
2-[(4-chlorophenyl)methylamino]cycloheptan-1-ol
CID 60901146
trans-(1R,2R)-2-[(3-methylphenyl)methylamino]cyclohexan-1-ol
CID 93382278
2-N-benzyl-1-N-methylcyclohexane-1,2-diamine
CID 149139761
N-benzyl-2-chlorocyclohexan-1-amine
CID 65025438
2-(3-phenylpropylamino)cyclohexan-1-ol
CID 45358268
2-[4-[[[(1S,2S)-2-hydroxycyclohexyl]amino]methyl]phenyl]benzoic acid
CID 110097453
1-N-benzyl-2-N-[(4-methylphenyl)methyl]cyclohexane-1,2-diamine
CID 71501767
2-[(2-hydroxyphenyl)methylamino]cycloheptan-1-ol
CID 113394671

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(benzylamino)cyclohexan-1-ol?
The IUPAC name of (1R)-2-(benzylamino)cyclohexan-1-ol (CID 67149916) is (1R)-2-(benzylamino)cyclohexan-1-ol.
What is the SMILES notation for (1R)-2-(benzylamino)cyclohexan-1-ol?
The canonical SMILES for (1R)-2-(benzylamino)cyclohexan-1-ol is O[C@@H]1CCCCC1NCc1ccccc1.
What is the InChIKey of (1R)-2-(benzylamino)cyclohexan-1-ol?
The InChIKey is NJNCYFUGUYIMEQ-ZGTCLIOFSA-N. The full InChI is InChI=1S/C13H19NO/c15-13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h1-3,6-7,12-15H,4-5,8-10H2/t12?,13-/m1/s1.
What are the key properties of (1R)-2-(benzylamino)cyclohexan-1-ol?
(1R)-2-(benzylamino)cyclohexan-1-ol has a molecular weight of 205.30 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(benzylamino)cyclohexan-1-ol is sourced from PubChem (CID 67149916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).