4-butyl-N-cyclopentylpiperazine-1-carboxamide

C14H27N3O — CID 17185788

IUPAC4-butyl-N-cyclopentylpiperazine-1-carboxamide
SMILESCCCCN1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-2-3-8-16-9-11-17(12-10-16)14(18)15-13-6-4-5-7-13/h13H,2-12H2,1H3,(H,15,18)
InChIKeyDWMAFKXGZPMRHA-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.06
Rot. Bonds4

About 4-butyl-N-cyclopentylpiperazine-1-carboxamide

4-butyl-N-cyclopentylpiperazine-1-carboxamide (PubChem CID 17185788) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 4-butyl-N-cyclopentylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-butyl-N-cyclopentylpiperazine-1-carboxamide
PubChem CID17185788
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name4-butyl-N-cyclopentylpiperazine-1-carboxamide
SMILESCCCCN1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-2-3-8-16-9-11-17(12-10-16)14(18)15-13-6-4-5-7-13/h13H,2-12H2,1H3,(H,15,18)
InChIKeyDWMAFKXGZPMRHA-UHFFFAOYSA-N
XLogP2.06
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-cyclopentylpiperazine-1-carboxamide?
The IUPAC name of 4-butyl-N-cyclopentylpiperazine-1-carboxamide (CID 17185788) is 4-butyl-N-cyclopentylpiperazine-1-carboxamide.
What is the SMILES notation for 4-butyl-N-cyclopentylpiperazine-1-carboxamide?
The canonical SMILES for 4-butyl-N-cyclopentylpiperazine-1-carboxamide is CCCCN1CCN(C(=O)NC2CCCC2)CC1.
What is the InChIKey of 4-butyl-N-cyclopentylpiperazine-1-carboxamide?
The InChIKey is DWMAFKXGZPMRHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-2-3-8-16-9-11-17(12-10-16)14(18)15-13-6-4-5-7-13/h13H,2-12H2,1H3,(H,15,18).
What are the key properties of 4-butyl-N-cyclopentylpiperazine-1-carboxamide?
4-butyl-N-cyclopentylpiperazine-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-cyclopentylpiperazine-1-carboxamide is sourced from PubChem (CID 17185788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).