1-(4-aminophenyl)-2-cyclopentylethanol

C13H19NO — CID 106695429

IUPAC1-(4-aminophenyl)-2-cyclopentylethanol
SMILESNc1ccc(C(O)CC2CCCC2)cc1
InChIInChI=1S/C13H19NO/c14-12-7-5-11(6-8-12)13(15)9-10-3-1-2-4-10/h5-8,10,13,15H,1-4,9,14H2
InChIKeyIGHJOEIUYRRUKX-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.88
Rot. Bonds3

About 1-(4-aminophenyl)-2-cyclopentylethanol

1-(4-aminophenyl)-2-cyclopentylethanol (PubChem CID 106695429) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(4-aminophenyl)-2-cyclopentylethanol.

Molecular Properties

Compound Name1-(4-aminophenyl)-2-cyclopentylethanol
PubChem CID106695429
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(4-aminophenyl)-2-cyclopentylethanol
SMILESNc1ccc(C(O)CC2CCCC2)cc1
InChIInChI=1S/C13H19NO/c14-12-7-5-11(6-8-12)13(15)9-10-3-1-2-4-10/h5-8,10,13,15H,1-4,9,14H2
InChIKeyIGHJOEIUYRRUKX-UHFFFAOYSA-N
XLogP2.88
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-aminophenyl)-2-cyclobutylethanol
CID 106695629
2-cyclopentyl-1-[4-(difluoromethyl)phenyl]ethanol
CID 115525070
2-cyclopentyl-1-phenylethanol
CID 15629098
2-cyclopentyl-1-(4-cyclopropyloxyphenyl)ethanol
CID 115838412
2-cyclohexyl-1-pyridin-4-ylethanol
CID 62606485
2-cyclopentyl-1-[4-(dimethylamino)phenyl]ethanol
CID 65151167
1-(4-aminophenyl)-2-pyrrolidin-2-ylethanol
CID 84674533
2-cyclopentyl-1-(4-propan-2-yloxyphenyl)ethanol
CID 61086888
2-cyclopentyl-1-[4-(difluoromethoxy)phenyl]ethanol
CID 65150469
2-cyclopentyl-1-(4-ethoxyphenyl)ethanol
CID 61101248
1-(4-aminophenyl)-3-cyclopropylpropan-1-ol
CID 106695552
2-cyclohexyl-1-[4-(difluoromethoxy)phenyl]ethanol
CID 65145450

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminophenyl)-2-cyclopentylethanol?
The IUPAC name of 1-(4-aminophenyl)-2-cyclopentylethanol (CID 106695429) is 1-(4-aminophenyl)-2-cyclopentylethanol.
What is the SMILES notation for 1-(4-aminophenyl)-2-cyclopentylethanol?
The canonical SMILES for 1-(4-aminophenyl)-2-cyclopentylethanol is Nc1ccc(C(O)CC2CCCC2)cc1.
What is the InChIKey of 1-(4-aminophenyl)-2-cyclopentylethanol?
The InChIKey is IGHJOEIUYRRUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c14-12-7-5-11(6-8-12)13(15)9-10-3-1-2-4-10/h5-8,10,13,15H,1-4,9,14H2.
What are the key properties of 1-(4-aminophenyl)-2-cyclopentylethanol?
1-(4-aminophenyl)-2-cyclopentylethanol has a molecular weight of 205.30 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminophenyl)-2-cyclopentylethanol is sourced from PubChem (CID 106695429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).