[2-(2-phenoxyethylamino)cyclopentyl]methanol

C14H21NO2 — CID 106360671

IUPAC[2-(2-phenoxyethylamino)cyclopentyl]methanol
SMILESOCC1CCCC1NCCOc1ccccc1
InChIInChI=1S/C14H21NO2/c16-11-12-5-4-8-14(12)15-9-10-17-13-6-2-1-3-7-13/h1-3,6-7,12,14-16H,4-5,8-11H2
InChIKeyHLOITVUSDQLLDC-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.82
Rot. Bonds6

About [2-(2-phenoxyethylamino)cyclopentyl]methanol

[2-(2-phenoxyethylamino)cyclopentyl]methanol (PubChem CID 106360671) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is [2-(2-phenoxyethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-(2-phenoxyethylamino)cyclopentyl]methanol
PubChem CID106360671
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name[2-(2-phenoxyethylamino)cyclopentyl]methanol
SMILESOCC1CCCC1NCCOc1ccccc1
InChIInChI=1S/C14H21NO2/c16-11-12-5-4-8-14(12)15-9-10-17-13-6-2-1-3-7-13/h1-3,6-7,12,14-16H,4-5,8-11H2
InChIKeyHLOITVUSDQLLDC-UHFFFAOYSA-N
XLogP1.82
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-phenoxyethylamino)cyclohexan-1-ol
CID 54943356
1-[[2-(hydroxymethyl)cyclopentyl]amino]-3-phenoxypropan-2-ol
CID 106360731
[2-(2-phenylethylamino)cyclopentyl]methanol
CID 104864522
2-(3-phenoxypropyl)-N-propylcyclopentan-1-amine
CID 62937136
2-(3-phenoxypropyl)-N-propylcyclohexan-1-amine
CID 62937483
[2-[(4-propoxyphenyl)methylamino]cyclopentyl]methanol
CID 103700395
N-[2-(3-bromophenoxy)ethyl]-2-(chloromethyl)cyclopentan-1-amine
CID 114179259
N-(3-phenoxypropyl)cyclohexanamine
CID 60683732
3-[2-[(2-hydroxycyclohexyl)amino]ethoxy]benzoic acid
CID 103249841
[2-[(2,2-difluoro-2-phenylethyl)amino]cyclopentyl]methanol
CID 114178654
2-methyl-N-(3-phenoxypropyl)cyclopropan-1-amine
CID 62936608
4-tert-butyl-N-(2-phenoxyethyl)cycloheptan-1-amine
CID 65089931

Frequently Asked Questions

What is the IUPAC name of [2-(2-phenoxyethylamino)cyclopentyl]methanol?
The IUPAC name of [2-(2-phenoxyethylamino)cyclopentyl]methanol (CID 106360671) is [2-(2-phenoxyethylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-(2-phenoxyethylamino)cyclopentyl]methanol?
The canonical SMILES for [2-(2-phenoxyethylamino)cyclopentyl]methanol is OCC1CCCC1NCCOc1ccccc1.
What is the InChIKey of [2-(2-phenoxyethylamino)cyclopentyl]methanol?
The InChIKey is HLOITVUSDQLLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c16-11-12-5-4-8-14(12)15-9-10-17-13-6-2-1-3-7-13/h1-3,6-7,12,14-16H,4-5,8-11H2.
What are the key properties of [2-(2-phenoxyethylamino)cyclopentyl]methanol?
[2-(2-phenoxyethylamino)cyclopentyl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-phenoxyethylamino)cyclopentyl]methanol is sourced from PubChem (CID 106360671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).