(1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine

C15H23N — CID 67209455

IUPAC(1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine
SMILESC[C@H](N[C@H](C)c1ccccc1)C1CCCC1
InChIInChI=1S/C15H23N/c1-12(14-8-4-3-5-9-14)16-13(2)15-10-6-7-11-15/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3/t12-,13+/m1/s1
InChIKeyNJDSVKSZAXISGC-OLZOCXBDSA-N
MW217.36 g/mol
LogP3.92
Rot. Bonds4

About (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine

(1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine (PubChem CID 67209455) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine.

Molecular Properties

Compound Name(1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine
PubChem CID67209455
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name(1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine
SMILESC[C@H](N[C@H](C)c1ccccc1)C1CCCC1
InChIInChI=1S/C15H23N/c1-12(14-8-4-3-5-9-14)16-13(2)15-10-6-7-11-15/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3/t12-,13+/m1/s1
InChIKeyNJDSVKSZAXISGC-OLZOCXBDSA-N
XLogP3.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-N-[1-(4-methylphenyl)ethyl]ethanamine
CID 55097109
(1S)-1-cycloheptyl-N-[1-(4-methylphenyl)ethyl]ethanamine
CID 81389876
1-cyclohexyl-N-[(1S)-1-(4-fluorophenyl)ethyl]ethanamine
CID 81348448
(1S)-N-[1-(4-tert-butylphenyl)ethyl]-1-cyclopentylethanamine
CID 81386295
4-[1-(1-cyclohexylethylamino)ethyl]phenol
CID 62405535
1-cyclopentyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]ethanamine
CID 63445435
2-(1-cyclopentylethylamino)-2-phenylethanol
CID 63182560
1-cyclohexyl-N-[1-(4-methylsulfanylphenyl)ethyl]ethanamine
CID 43783226
1-(1-ethylpiperidin-3-yl)-N-[(1R)-1-phenylethyl]ethanamine
CID 81351660
(1S)-1-cycloheptyl-N-[1-(2-methylphenyl)ethyl]ethanamine
CID 81390722
(1S)-1-cyclopentyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]ethanamine
CID 81473468
(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine
CID 81395665

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine?
The IUPAC name of (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine (CID 67209455) is (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine.
What is the SMILES notation for (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine?
The canonical SMILES for (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine is C[C@H](N[C@H](C)c1ccccc1)C1CCCC1.
What is the InChIKey of (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine?
The InChIKey is NJDSVKSZAXISGC-OLZOCXBDSA-N. The full InChI is InChI=1S/C15H23N/c1-12(14-8-4-3-5-9-14)16-13(2)15-10-6-7-11-15/h3-5,8-9,12-13,15-16H,6-7,10-11H2,1-2H3/t12-,13+/m1/s1.
What are the key properties of (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine?
(1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclopentyl-N-[(1R)-1-phenylethyl]ethanamine is sourced from PubChem (CID 67209455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).