N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide

C15H23N3OS — CID 17174341

IUPACN-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCN(Cc2cccs2)CC1
InChIInChI=1S/C15H23N3OS/c19-15(16-13-4-1-2-5-13)18-9-7-17(8-10-18)12-14-6-3-11-20-14/h3,6,11,13H,1-2,4-5,7-10,12H2,(H,16,19)
InChIKeyWIOHNQLNHKPZIJ-UHFFFAOYSA-N
MW293.44 g/mol
LogP2.52
Rot. Bonds3

About N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide

N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide (PubChem CID 17174341) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide
PubChem CID17174341
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC NameN-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCN(Cc2cccs2)CC1
InChIInChI=1S/C15H23N3OS/c19-15(16-13-4-1-2-5-13)18-9-7-17(8-10-18)12-14-6-3-11-20-14/h3,6,11,13H,1-2,4-5,7-10,12H2,(H,16,19)
InChIKeyWIOHNQLNHKPZIJ-UHFFFAOYSA-N
XLogP2.52
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide (CID 17174341) is N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide is O=C(NC1CCCC1)N1CCN(Cc2cccs2)CC1.
What is the InChIKey of N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide?
The InChIKey is WIOHNQLNHKPZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c19-15(16-13-4-1-2-5-13)18-9-7-17(8-10-18)12-14-6-3-11-20-14/h3,6,11,13H,1-2,4-5,7-10,12H2,(H,16,19).
What are the key properties of N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide?
N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide has a molecular weight of 293.44 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide is sourced from PubChem (CID 17174341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).