3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine

C17H35N — CID 82922992

IUPAC3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine
SMILESCCCNC(CC(CC)CC)C1CCC(CC)C1
InChIInChI=1S/C17H35N/c1-5-11-18-17(13-14(6-2)7-3)16-10-9-15(8-4)12-16/h14-18H,5-13H2,1-4H3
InChIKeyKSBSHKMZTQWTJR-UHFFFAOYSA-N
MW253.47 g/mol
LogP5.01
Rot. Bonds9

About 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine

3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine (PubChem CID 82922992) has the molecular formula C17H35N and a molecular weight of 253.47 g/mol. Its IUPAC name is 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine
PubChem CID82922992
Molecular FormulaC17H35N
Molecular Weight253.47 g/mol
Exact Mass253.28
IUPAC Name3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine
SMILESCCCNC(CC(CC)CC)C1CCC(CC)C1
InChIInChI=1S/C17H35N/c1-5-11-18-17(13-14(6-2)7-3)16-10-9-15(8-4)12-16/h14-18H,5-13H2,1-4H3
InChIKeyKSBSHKMZTQWTJR-UHFFFAOYSA-N
XLogP5.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500253.47
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-ethylcyclopentyl)-N-propylpent-3-yn-1-amine
CID 65411828
1-cyclopropyl-3-ethyl-N-propylheptan-1-amine
CID 63413488
N',N'-diethyl-1-(3-ethylcyclohexyl)-N-propylpropane-1,3-diamine
CID 79093322
N-[1-(3-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]propan-1-amine
CID 105156181
4-(4-ethylcyclohexyl)-N-propylpentan-2-amine
CID 64774084
1-(3-ethylcyclohexyl)-4-methoxy-N-propylpentan-1-amine
CID 105156081
1-(3-ethylcyclopentyl)-2-methyl-N-propylpentan-1-amine
CID 114013790
N-[2-(4-bromothiophen-2-yl)-1-(3-ethylcyclopentyl)ethyl]propan-1-amine
CID 65412607
N-[cyclobutyl-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 64986298
1-(3,4-dimethylcyclohexyl)-3-methyl-N-propylpentan-1-amine
CID 104989433
1-(3-ethylcyclohexyl)-4-methoxy-4-methyl-N-propylpentan-1-amine
CID 103035736
1-(3-ethylcyclohexyl)-4-methylsulfonyl-N-propylbutan-1-amine
CID 65415766

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine?
The IUPAC name of 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine (CID 82922992) is 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine.
What is the SMILES notation for 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine?
The canonical SMILES for 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine is CCCNC(CC(CC)CC)C1CCC(CC)C1.
What is the InChIKey of 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine?
The InChIKey is KSBSHKMZTQWTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N/c1-5-11-18-17(13-14(6-2)7-3)16-10-9-15(8-4)12-16/h14-18H,5-13H2,1-4H3.
What are the key properties of 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine?
3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine has a molecular weight of 253.47 g/mol, XLogP of 5.01, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(3-ethylcyclopentyl)-N-propylpentan-1-amine is sourced from PubChem (CID 82922992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).