[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol

C14H19Cl2NO — CID 62520254

IUPAC[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol
SMILESOCC1(NCc2c(Cl)cccc2Cl)CCCCC1
InChIInChI=1S/C14H19Cl2NO/c15-12-5-4-6-13(16)11(12)9-17-14(10-18)7-2-1-3-8-14/h4-6,17-18H,1-3,7-10H2
InChIKeyRDLFVYCALNLDHZ-UHFFFAOYSA-N
MW288.22 g/mol
LogP3.78
Rot. Bonds4

About [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol

[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol (PubChem CID 62520254) has the molecular formula C14H19Cl2NO and a molecular weight of 288.22 g/mol. Its IUPAC name is [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol
PubChem CID62520254
Molecular FormulaC14H19Cl2NO
Molecular Weight288.22 g/mol
Exact Mass287.08
IUPAC Name[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol
SMILESOCC1(NCc2c(Cl)cccc2Cl)CCCCC1
InChIInChI=1S/C14H19Cl2NO/c15-12-5-4-6-13(16)11(12)9-17-14(10-18)7-2-1-3-8-14/h4-6,17-18H,1-3,7-10H2
InChIKeyRDLFVYCALNLDHZ-UHFFFAOYSA-N
XLogP3.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol 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

[1-[(2-chloro-6-methylsulfonylphenyl)methylamino]cyclopentyl]methanol
CID 83169882
1-(chloromethyl)-N-[(2,6-dichlorophenyl)methyl]cyclopentan-1-amine
CID 65025996
2-chloro-6-[[[1-(hydroxymethyl)cyclobutyl]amino]methyl]phenol
CID 115924196
2-(2,6-dichlorophenyl)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62522014
3-chloro-2-[[[1-(hydroxymethyl)-3-methylcyclohexyl]amino]methyl]phenol
CID 114318191
[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclohexyl]methanol
CID 103965941
1-[[[1-(hydroxymethyl)cyclohexyl]amino]methyl]naphthalen-2-ol
CID 62520425
[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol
CID 113293557
[1-[(4-bromo-2-chlorophenyl)methylamino]cyclopentyl]methanol
CID 115683768
[1-(thiophen-2-ylmethylamino)cyclooctyl]methanol
CID 61056403
[1-[(2-fluorophenyl)methylamino]cyclohexyl]methanol
CID 55082363
2,6-dichloro-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 62519426

Frequently Asked Questions

What is the IUPAC name of [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol?
The IUPAC name of [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol (CID 62520254) is [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol.
What is the SMILES notation for [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol?
The canonical SMILES for [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol is OCC1(NCc2c(Cl)cccc2Cl)CCCCC1.
What is the InChIKey of [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol?
The InChIKey is RDLFVYCALNLDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2NO/c15-12-5-4-6-13(16)11(12)9-17-14(10-18)7-2-1-3-8-14/h4-6,17-18H,1-3,7-10H2.
What are the key properties of [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol?
[1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol has a molecular weight of 288.22 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2,6-dichlorophenyl)methylamino]cyclohexyl]methanol is sourced from PubChem (CID 62520254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).