N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide

C14H22N4OS — CID 38270326

IUPACN-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESCc1csc(N2CCN(C(=O)NC3CCCC3)CC2)n1
InChIInChI=1S/C14H22N4OS/c1-11-10-20-14(15-11)18-8-6-17(7-9-18)13(19)16-12-4-2-3-5-12/h10,12H,2-9H2,1H3,(H,16,19)
InChIKeyXYIYLWWGJOKYIZ-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.23
Rot. Bonds2

About N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide

N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide (PubChem CID 38270326) has the molecular formula C14H22N4OS and a molecular weight of 294.42 g/mol. Its IUPAC name is N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
PubChem CID38270326
Molecular FormulaC14H22N4OS
Molecular Weight294.42 g/mol
Exact Mass294.15
IUPAC NameN-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESCc1csc(N2CCN(C(=O)NC3CCCC3)CC2)n1
InChIInChI=1S/C14H22N4OS/c1-11-10-20-14(15-11)18-8-6-17(7-9-18)13(19)16-12-4-2-3-5-12/h10,12H,2-9H2,1H3,(H,16,19)
InChIKeyXYIYLWWGJOKYIZ-UHFFFAOYSA-N
XLogP2.23
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide (CID 38270326) is N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide is Cc1csc(N2CCN(C(=O)NC3CCCC3)CC2)n1.
What is the InChIKey of N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide?
The InChIKey is XYIYLWWGJOKYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4OS/c1-11-10-20-14(15-11)18-8-6-17(7-9-18)13(19)16-12-4-2-3-5-12/h10,12H,2-9H2,1H3,(H,16,19).
What are the key properties of N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide?
N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide has a molecular weight of 294.42 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(4-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide is sourced from PubChem (CID 38270326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).