2-anilino-2-cyclopentylethanol

C13H19NO — CID 62071600

IUPAC2-anilino-2-cyclopentylethanol
SMILESOCC(Nc1ccccc1)C1CCCC1
InChIInChI=1S/C13H19NO/c15-10-13(11-6-4-5-7-11)14-12-8-2-1-3-9-12/h1-3,8-9,11,13-15H,4-7,10H2
InChIKeyZWSXBLSNMAGLKN-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.65
Rot. Bonds4

About 2-anilino-2-cyclopentylethanol

2-anilino-2-cyclopentylethanol (PubChem CID 62071600) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-anilino-2-cyclopentylethanol.

Molecular Properties

Compound Name2-anilino-2-cyclopentylethanol
PubChem CID62071600
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-anilino-2-cyclopentylethanol
SMILESOCC(Nc1ccccc1)C1CCCC1
InChIInChI=1S/C13H19NO/c15-10-13(11-6-4-5-7-11)14-12-8-2-1-3-9-12/h1-3,8-9,11,13-15H,4-7,10H2
InChIKeyZWSXBLSNMAGLKN-UHFFFAOYSA-N
XLogP2.65
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloroanilino)-2-cyclopentylethanol
CID 62072297
1-cyclopentyl-N-phenylethane-1,2-diamine
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2-cyclopropyl-2-(4-fluoroanilino)ethanol
CID 61310926
N-(1-cyclopropylpropyl)aniline;hydrochloride
CID 174269039
2-(2-chloroanilino)-2-cyclopropylethanol
CID 61310756
1-(1-cyclohexyl-3-hydroxypropyl)-3-phenylurea
CID 111383992
N-(1-cyclobutylethyl)aniline
CID 58933203
2-anilino-2-cyclohexylacetamide
CID 54889288
N-(1-cyclopentylpropan-2-yl)aniline
CID 135004448
N-[(2S,3S)-3-cyclohexylpentan-2-yl]aniline
CID 166439055
N-(1-cyclohexyl-2,2,2-trifluoroethyl)aniline
CID 11076093
2-(3-methoxyanilino)-2-(oxan-4-yl)ethanol
CID 62392316

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-cyclopentylethanol?
The IUPAC name of 2-anilino-2-cyclopentylethanol (CID 62071600) is 2-anilino-2-cyclopentylethanol.
What is the SMILES notation for 2-anilino-2-cyclopentylethanol?
The canonical SMILES for 2-anilino-2-cyclopentylethanol is OCC(Nc1ccccc1)C1CCCC1.
What is the InChIKey of 2-anilino-2-cyclopentylethanol?
The InChIKey is ZWSXBLSNMAGLKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c15-10-13(11-6-4-5-7-11)14-12-8-2-1-3-9-12/h1-3,8-9,11,13-15H,4-7,10H2.
What are the key properties of 2-anilino-2-cyclopentylethanol?
2-anilino-2-cyclopentylethanol has a molecular weight of 205.30 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-cyclopentylethanol is sourced from PubChem (CID 62071600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).