3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine

C16H25N — CID 81349259

IUPAC3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine
SMILESCCC1CCC(N[C@H](C)c2ccc(C)cc2)C1
InChIInChI=1S/C16H25N/c1-4-14-7-10-16(11-14)17-13(3)15-8-5-12(2)6-9-15/h5-6,8-9,13-14,16-17H,4,7,10-11H2,1-3H3/t13-,14?,16?/m1/s1
InChIKeyYHTRTXTUQWDULN-VQCLRJIVSA-N
MW231.38 g/mol
LogP4.22
Rot. Bonds4

About 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine

3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine (PubChem CID 81349259) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine
PubChem CID81349259
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine
SMILESCCC1CCC(N[C@H](C)c2ccc(C)cc2)C1
InChIInChI=1S/C16H25N/c1-4-14-7-10-16(11-14)17-13(3)15-8-5-12(2)6-9-15/h5-6,8-9,13-14,16-17H,4,7,10-11H2,1-3H3/t13-,14?,16?/m1/s1
InChIKeyYHTRTXTUQWDULN-VQCLRJIVSA-N
XLogP4.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-N-[(1S)-1-pyridin-4-ylethyl]cyclopentan-1-amine
CID 81405604
N-[1-(4-methylphenyl)ethyl]cyclopropanamine
CID 16771025
3-ethyl-N-[(1S)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine
CID 81360857
4-[1-[(3-ethylcyclopentyl)amino]ethyl]benzenesulfonamide
CID 64502296
3-ethyl-N-[1-(4-iodophenyl)ethyl]cyclohexan-1-amine
CID 64742976
1-N-[(1R)-1-(4-methylphenyl)ethyl]cyclobutane-1,3-diamine
CID 81349548
N-[(1R)-1-(4-methylphenyl)ethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81349637
3-ethyl-N-[(1R)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 81371165
N-[1-(4-methylphenyl)ethyl]-3-propan-2-ylcyclobutan-1-amine
CID 103561638
2-[1-[(4-ethylcyclohexyl)amino]ethyl]-4-methylphenol
CID 61466696
4-[1-[(4-ethylcyclohexyl)amino]ethyl]benzenesulfonamide
CID 43681869
4-tert-butyl-N-[(1S)-1-(4-methylphenyl)ethyl]cyclohexan-1-amine
CID 81355631

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine?
The IUPAC name of 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine (CID 81349259) is 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine is CCC1CCC(N[C@H](C)c2ccc(C)cc2)C1.
What is the InChIKey of 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine?
The InChIKey is YHTRTXTUQWDULN-VQCLRJIVSA-N. The full InChI is InChI=1S/C16H25N/c1-4-14-7-10-16(11-14)17-13(3)15-8-5-12(2)6-9-15/h5-6,8-9,13-14,16-17H,4,7,10-11H2,1-3H3/t13-,14?,16?/m1/s1.
What are the key properties of 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine?
3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(1R)-1-(4-methylphenyl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 81349259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).