1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine

C15H31N3 — CID 64501374

IUPAC1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine
SMILESCCC1CCC(CN)(N2CCC(N(C)C)CC2)C1
InChIInChI=1S/C15H31N3/c1-4-13-5-8-15(11-13,12-16)18-9-6-14(7-10-18)17(2)3/h13-14H,4-12,16H2,1-3H3
InChIKeyYLBBQCDVFAKJRR-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.92
Rot. Bonds4

About 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine

1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine (PubChem CID 64501374) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine
PubChem CID64501374
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine
SMILESCCC1CCC(CN)(N2CCC(N(C)C)CC2)C1
InChIInChI=1S/C15H31N3/c1-4-13-5-8-15(11-13,12-16)18-9-6-14(7-10-18)17(2)3/h13-14H,4-12,16H2,1-3H3
InChIKeyYLBBQCDVFAKJRR-UHFFFAOYSA-N
XLogP1.92
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine (CID 64501374) is 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine is CCC1CCC(CN)(N2CCC(N(C)C)CC2)C1.
What is the InChIKey of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is YLBBQCDVFAKJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-4-13-5-8-15(11-13,12-16)18-9-6-14(7-10-18)17(2)3/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine?
1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 253.43 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(aminomethyl)-3-ethylcyclopentyl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 64501374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).