1-cyclopentyl-2-phenylethanamine

C13H19N — CID 50988646

IUPAC1-cyclopentyl-2-phenylethanamine
SMILESNC(Cc1ccccc1)C1CCCC1
InChIInChI=1S/C13H19N/c14-13(12-8-4-5-9-12)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2
InChIKeyHFYGDTFACFGSDK-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.75
Rot. Bonds3

About 1-cyclopentyl-2-phenylethanamine

1-cyclopentyl-2-phenylethanamine (PubChem CID 50988646) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 1-cyclopentyl-2-phenylethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-phenylethanamine
PubChem CID50988646
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name1-cyclopentyl-2-phenylethanamine
SMILESNC(Cc1ccccc1)C1CCCC1
InChIInChI=1S/C13H19N/c14-13(12-8-4-5-9-12)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2
InChIKeyHFYGDTFACFGSDK-UHFFFAOYSA-N
XLogP2.75
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-cyclobutyl-2-phenylethanamine;phosphane
CID 143108875
1-cycloheptyl-3-phenylpropan-1-amine
CID 65399790
2-(3-chlorophenyl)-1-cyclopentylethanamine
CID 60818439
1-(1-ethylpiperidin-4-yl)-2-phenylethanamine
CID 142846398
1-cyclopentyl-2-pyridin-3-ylethanamine
CID 62553066
(1R)-1-(oxetan-3-yl)-2-phenylethanamine
CID 162341038
2-(4-tert-butylphenyl)-1-cyclohexylethanamine
CID 63411930
(1R)-1-cyclopentyl-2-phenylethanol
CID 39238299
(1R)-1-cyclobutyl-3-phenylpropan-1-amine;hydrochloride
CID 11535925
1-cyclopentyl-2-phenylmethoxyethanamine;hydrochloride
CID 67701372
2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404384
2-cyclohexyl-4-phenylbutane-1,3-diamine
CID 20848425

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-phenylethanamine?
The IUPAC name of 1-cyclopentyl-2-phenylethanamine (CID 50988646) is 1-cyclopentyl-2-phenylethanamine.
What is the SMILES notation for 1-cyclopentyl-2-phenylethanamine?
The canonical SMILES for 1-cyclopentyl-2-phenylethanamine is NC(Cc1ccccc1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-phenylethanamine?
The InChIKey is HFYGDTFACFGSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c14-13(12-8-4-5-9-12)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2.
What are the key properties of 1-cyclopentyl-2-phenylethanamine?
1-cyclopentyl-2-phenylethanamine has a molecular weight of 189.30 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-phenylethanamine is sourced from PubChem (CID 50988646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).