1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine

C19H29N — CID 105053655

IUPAC1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine
SMILESCCNC(CC1CCCC1)c1cccc(C2CCC2)c1
InChIInChI=1S/C19H29N/c1-2-20-19(13-15-7-3-4-8-15)18-12-6-11-17(14-18)16-9-5-10-16/h6,11-12,14-16,19-20H,2-5,7-10,13H2,1H3
InChIKeyHYPKCSKKNLQKTL-UHFFFAOYSA-N
MW271.45 g/mol
LogP5.18
Rot. Bonds6

About 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine

1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine (PubChem CID 105053655) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine.

Molecular Properties

Compound Name1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine
PubChem CID105053655
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC Name1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine
SMILESCCNC(CC1CCCC1)c1cccc(C2CCC2)c1
InChIInChI=1S/C19H29N/c1-2-20-19(13-15-7-3-4-8-15)18-12-6-11-17(14-18)16-9-5-10-16/h6,11-12,14-16,19-20H,2-5,7-10,13H2,1H3
InChIKeyHYPKCSKKNLQKTL-UHFFFAOYSA-N
XLogP5.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.45
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(3-cyclobutylphenyl)-2-cyclopropylethyl]propan-1-amine
CID 114604146
1-(3-cyclobutylphenyl)-N-ethyl-3,3-dimethylbutan-1-amine
CID 114603052
2-cyclopentyl-1-(3-cyclopropyloxyphenyl)-N-ethylethanamine
CID 105051728
1-(3-cyclobutylphenyl)-N-ethyl-2-propan-2-ylsulfanylethanamine
CID 114603256
1-(3-cyclobutylphenyl)-N-ethylethanamine
CID 114602707
1-(3-cyclobutylphenyl)-N,N',N'-triethylpropane-1,3-diamine
CID 114603814
1-(3-cyclobutylphenyl)propylhydrazine
CID 105200963
1-(3-cyclobutylphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 114604522
1-(3-cyclobutylphenyl)-2-(cyclohexen-1-yl)-N-ethylethanamine
CID 114604658
1-(3-cyclobutylphenyl)-N-ethyl-3-(oxolan-2-yl)propan-1-amine
CID 105053635
1-(3-cyclobutylphenyl)-N-ethyl-2-propylpentan-1-amine
CID 105053791
N-[(3-cyclobutylphenyl)-(4-methylphenyl)methyl]ethanamine
CID 114602617

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine?
The IUPAC name of 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine (CID 105053655) is 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine.
What is the SMILES notation for 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine?
The canonical SMILES for 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine is CCNC(CC1CCCC1)c1cccc(C2CCC2)c1.
What is the InChIKey of 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine?
The InChIKey is HYPKCSKKNLQKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-2-20-19(13-15-7-3-4-8-15)18-12-6-11-17(14-18)16-9-5-10-16/h6,11-12,14-16,19-20H,2-5,7-10,13H2,1H3.
What are the key properties of 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine?
1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine has a molecular weight of 271.45 g/mol, XLogP of 5.18, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclobutylphenyl)-2-cyclopentyl-N-ethylethanamine is sourced from PubChem (CID 105053655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).