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

C14H19Cl2NO — CID 113293557

IUPAC[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol
SMILESOCC1(CNCc2c(Cl)cccc2Cl)CCCC1
InChIInChI=1S/C14H19Cl2NO/c15-12-4-3-5-13(16)11(12)8-17-9-14(10-18)6-1-2-7-14/h3-5,17-18H,1-2,6-10H2
InChIKeyOCBXGHIZYLIIRI-UHFFFAOYSA-N
MW288.22 g/mol
LogP3.64
Rot. Bonds5

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

[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol (PubChem CID 113293557) has the molecular formula C14H19Cl2NO and a molecular weight of 288.22 g/mol. Its IUPAC name is [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol
PubChem CID113293557
Molecular FormulaC14H19Cl2NO
Molecular Weight288.22 g/mol
Exact Mass287.08
IUPAC Name[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol
SMILESOCC1(CNCc2c(Cl)cccc2Cl)CCCC1
InChIInChI=1S/C14H19Cl2NO/c15-12-4-3-5-13(16)11(12)8-17-9-14(10-18)6-1-2-7-14/h3-5,17-18H,1-2,6-10H2
InChIKeyOCBXGHIZYLIIRI-UHFFFAOYSA-N
XLogP3.64
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]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-[[(2,6-dichlorophenyl)methylamino]methyl]cyclohexyl]methanol
CID 103965941
N-[[1-(chloromethyl)cyclohexyl]methyl]-1-(2,6-dichlorophenyl)methanamine
CID 113359870
[1-[[(2-chloro-6-nitrophenyl)methylamino]methyl]cyclopropyl]methanol
CID 113313226
[1-[[(3-chlorophenyl)methylamino]methyl]cyclopentyl]methanol
CID 113293650
[1-[[(2,6-difluorophenyl)methylamino]methyl]cyclopropyl]methanol
CID 79478439
3-chloro-2-[[(1-hydroxycyclopentyl)methylamino]methyl]phenol
CID 78960288
2,6-dichloro-N-[[1-(hydroxymethyl)cyclohexyl]methyl]benzenesulfonamide
CID 115755568
[1-[(2-chloro-6-fluorophenyl)methyl]cyclobutyl]methanol
CID 66024328
[1-[(2-chloro-6-fluorophenyl)methyl]cyclopentyl]methanol
CID 66026117
3-chloro-2-[[(1-hydroxycyclohexyl)methylamino]methyl]phenol
CID 78960594
[1-[[(5-chlorofuran-2-yl)methylamino]methyl]cyclopentyl]methanol
CID 115358933
2-(2,6-dichlorophenyl)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
CID 80711817

Frequently Asked Questions

What is the IUPAC name of [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol (CID 113293557) is [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol is OCC1(CNCc2c(Cl)cccc2Cl)CCCC1.
What is the InChIKey of [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol?
The InChIKey is OCBXGHIZYLIIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2NO/c15-12-4-3-5-13(16)11(12)8-17-9-14(10-18)6-1-2-7-14/h3-5,17-18H,1-2,6-10H2.
What are the key properties of [1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol?
[1-[[(2,6-dichlorophenyl)methylamino]methyl]cyclopentyl]methanol has a molecular weight of 288.22 g/mol, XLogP of 3.64, 5 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]methyl]cyclopentyl]methanol is sourced from PubChem (CID 113293557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).