(1R)-2-(4-methylanilino)cyclohexan-1-ol

C13H19NO — CID 134547011

IUPAC(1R)-2-(4-methylanilino)cyclohexan-1-ol
SMILESCc1ccc(NC2CCCC[C@H]2O)cc1
InChIInChI=1S/C13H19NO/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15/h6-9,12-15H,2-5H2,1H3/t12?,13-/m1/s1
InChIKeyJTCBCGKEWZZVIP-ZGTCLIOFSA-N
MW205.30 g/mol
LogP2.71
Rot. Bonds2

About (1R)-2-(4-methylanilino)cyclohexan-1-ol

(1R)-2-(4-methylanilino)cyclohexan-1-ol (PubChem CID 134547011) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (1R)-2-(4-methylanilino)cyclohexan-1-ol.

Molecular Properties

Compound Name(1R)-2-(4-methylanilino)cyclohexan-1-ol
PubChem CID134547011
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(1R)-2-(4-methylanilino)cyclohexan-1-ol
SMILESCc1ccc(NC2CCCC[C@H]2O)cc1
InChIInChI=1S/C13H19NO/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15/h6-9,12-15H,2-5H2,1H3/t12?,13-/m1/s1
InChIKeyJTCBCGKEWZZVIP-ZGTCLIOFSA-N
XLogP2.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1S,2S)-2-(4-methylanilino)cyclopentan-1-ol
CID 93345908
N-[(1S,2S)-2-hydroxycyclohexyl]-N'-(4-methylphenyl)oxamide
CID 104953006
2-(4-tert-butylanilino)cyclohexan-1-ol
CID 60884412
2-(4-aminoanilino)cyclohexan-1-ol
CID 62358477
2-(3,4-dimethylanilino)cycloheptan-1-ol
CID 60896994
trans-(1R,2R)-2-(4-methoxyanilino)cyclooctan-1-ol
CID 15891180
trans-(1S,2S)-2-(4-chloroanilino)cyclopentan-1-ol
CID 93345854
2-(4-iodoanilino)cyclopentan-1-ol
CID 60886056
trans-(1R,2R)-2-(4-propan-2-ylanilino)cyclopentan-1-ol
CID 102732975
trans-(1R,2R)-2-(3,4-dimethylanilino)cyclopentan-1-ol
CID 102732999
2-methyl-N-(4-methylphenyl)thian-3-amine
CID 79957900
4-[(2-hydroxycyclohexyl)amino]benzonitrile
CID 60884623

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(4-methylanilino)cyclohexan-1-ol?
The IUPAC name of (1R)-2-(4-methylanilino)cyclohexan-1-ol (CID 134547011) is (1R)-2-(4-methylanilino)cyclohexan-1-ol.
What is the SMILES notation for (1R)-2-(4-methylanilino)cyclohexan-1-ol?
The canonical SMILES for (1R)-2-(4-methylanilino)cyclohexan-1-ol is Cc1ccc(NC2CCCC[C@H]2O)cc1.
What is the InChIKey of (1R)-2-(4-methylanilino)cyclohexan-1-ol?
The InChIKey is JTCBCGKEWZZVIP-ZGTCLIOFSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15/h6-9,12-15H,2-5H2,1H3/t12?,13-/m1/s1.
What are the key properties of (1R)-2-(4-methylanilino)cyclohexan-1-ol?
(1R)-2-(4-methylanilino)cyclohexan-1-ol has a molecular weight of 205.30 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(4-methylanilino)cyclohexan-1-ol is sourced from PubChem (CID 134547011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).