3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine

C14H29N3 — CID 79642695

IUPAC3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine
SMILESCCCNC1CCC(N2CCN(CC)CC2)C1
InChIInChI=1S/C14H29N3/c1-3-7-15-13-5-6-14(12-13)17-10-8-16(4-2)9-11-17/h13-15H,3-12H2,1-2H3
InChIKeyYWUPQDOTLPGUKU-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.54
Rot. Bonds5

About 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine

3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine (PubChem CID 79642695) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine
PubChem CID79642695
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine
SMILESCCCNC1CCC(N2CCN(CC)CC2)C1
InChIInChI=1S/C14H29N3/c1-3-7-15-13-5-6-14(12-13)17-10-8-16(4-2)9-11-17/h13-15H,3-12H2,1-2H3
InChIKeyYWUPQDOTLPGUKU-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine?
The IUPAC name of 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine (CID 79642695) is 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine.
What is the SMILES notation for 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine?
The canonical SMILES for 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine is CCCNC1CCC(N2CCN(CC)CC2)C1.
What is the InChIKey of 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine?
The InChIKey is YWUPQDOTLPGUKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-3-7-15-13-5-6-14(12-13)17-10-8-16(4-2)9-11-17/h13-15H,3-12H2,1-2H3.
What are the key properties of 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine?
3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylpiperazin-1-yl)-N-propylcyclopentan-1-amine is sourced from PubChem (CID 79642695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).