3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine

C15H31N — CID 170028029

IUPAC3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine
SMILESCCCC1C(C)C(CCCN)C(C)C1CC
InChIInChI=1S/C15H31N/c1-5-8-15-12(4)14(9-7-10-16)11(3)13(15)6-2/h11-15H,5-10,16H2,1-4H3
InChIKeyVDENRVFBDZUIHO-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.07
Rot. Bonds6

About 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine

3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine (PubChem CID 170028029) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine.

Molecular Properties

Compound Name3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine
PubChem CID170028029
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine
SMILESCCCC1C(C)C(CCCN)C(C)C1CC
InChIInChI=1S/C15H31N/c1-5-8-15-12(4)14(9-7-10-16)11(3)13(15)6-2/h11-15H,5-10,16H2,1-4H3
InChIKeyVDENRVFBDZUIHO-UHFFFAOYSA-N
XLogP4.07
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-2-pentyl-3-propylcyclopropane
CID 123315526
1-ethyl-2-[2-(2-ethyl-3-methylcyclopropyl)ethyl]-3-methylcyclopropane
CID 90777753
2-[2-(2-ethyl-3-methylcyclopropyl)ethoxy]ethanamine
CID 91309834
1,2,3,4-tetramethyl-5-propylcyclopentane
CID 23231337
1,2,3-trimethyl-4-propylcyclobutane
CID 90876457
2-(2-ethyl-3-methylcyclopropyl)ethanol
CID 91526803
cis-(2R,3S)-2-methyl-3-propylcyclopropan-1-amine
CID 163640709
1,2-dimethyl-3-pentylcyclopropane
CID 524654
1-methyl-2,3-dipentyl-4-propan-2-ylcyclobutane
CID 123185482
1,2-dimethyl-3-pentylcyclopropane;ethane
CID 143707793
2-[2-(aminomethyl)-3-methylcyclopropyl]ethanamine
CID 123932345
1-heptyl-2,3,4,5-tetramethylcyclopentane
CID 59076832

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine?
The IUPAC name of 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine (CID 170028029) is 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine.
What is the SMILES notation for 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine?
The canonical SMILES for 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine is CCCC1C(C)C(CCCN)C(C)C1CC.
What is the InChIKey of 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine?
The InChIKey is VDENRVFBDZUIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-5-8-15-12(4)14(9-7-10-16)11(3)13(15)6-2/h11-15H,5-10,16H2,1-4H3.
What are the key properties of 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine?
3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethyl-2,5-dimethyl-4-propylcyclopentyl)propan-1-amine is sourced from PubChem (CID 170028029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).