[2-[(2-aminophenyl)methylamino]cyclopentyl]methanol

C13H20N2O — CID 106359504

IUPAC[2-[(2-aminophenyl)methylamino]cyclopentyl]methanol
SMILESNc1ccccc1CNC1CCCC1CO
InChIInChI=1S/C13H20N2O/c14-12-6-2-1-4-10(12)8-15-13-7-3-5-11(13)9-16/h1-2,4,6,11,13,15-16H,3,5,7-9,14H2
InChIKeyMKWWWIQSDWZLIA-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.52
Rot. Bonds4

About [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol

[2-[(2-aminophenyl)methylamino]cyclopentyl]methanol (PubChem CID 106359504) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(2-aminophenyl)methylamino]cyclopentyl]methanol
PubChem CID106359504
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name[2-[(2-aminophenyl)methylamino]cyclopentyl]methanol
SMILESNc1ccccc1CNC1CCCC1CO
InChIInChI=1S/C13H20N2O/c14-12-6-2-1-4-10(12)8-15-13-7-3-5-11(13)9-16/h1-2,4,6,11,13,15-16H,3,5,7-9,14H2
InChIKeyMKWWWIQSDWZLIA-UHFFFAOYSA-N
XLogP1.52
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze [2-[(2-aminophenyl)methylamino]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

3-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]benzene-1,2-diol
CID 113357915
2-chloro-6-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]phenol
CID 113352464
2-[[(2,3-dimethylcyclohexyl)amino]methyl]aniline
CID 66386630
[2-[(2-propan-2-yloxyphenyl)methylamino]cyclopentyl]methanol
CID 103700313
[2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)cyclopentyl]methanol
CID 103700403
2-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]aniline
CID 66418811
2-[[(2-aminophenyl)methylamino]methyl]cyclopentan-1-ol
CID 66419653
[2-[[5-(hydroxymethyl)furan-2-yl]methylamino]cyclopentyl]methanol
CID 115655020
2-amino-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103951112
N-[(2-aminophenyl)methyl]cyclooctanamine
CID 66385631
2-fluoro-N'-hydroxy-3-[[[2-(hydroxymethyl)cyclohexyl]amino]methyl]benzenecarboximidamide
CID 106361752
N'-hydroxy-3-[[[2-(hydroxymethyl)cyclohexyl]amino]methyl]pyridine-2-carboximidamide
CID 136746816

Frequently Asked Questions

What is the IUPAC name of [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol?
The IUPAC name of [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol (CID 106359504) is [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol is Nc1ccccc1CNC1CCCC1CO.
What is the InChIKey of [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol?
The InChIKey is MKWWWIQSDWZLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c14-12-6-2-1-4-10(12)8-15-13-7-3-5-11(13)9-16/h1-2,4,6,11,13,15-16H,3,5,7-9,14H2.
What are the key properties of [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol?
[2-[(2-aminophenyl)methylamino]cyclopentyl]methanol has a molecular weight of 220.32 g/mol, XLogP of 1.52, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-aminophenyl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 106359504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).