N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

C12H18N2O2S — CID 27162814

IUPACN-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCc1csc(=O)n1CCC(=O)NC1CCCC1
InChIInChI=1S/C12H18N2O2S/c1-9-8-17-12(16)14(9)7-6-11(15)13-10-4-2-3-5-10/h8,10H,2-7H2,1H3,(H,13,15)
InChIKeyJCDXYMCEFJAIAE-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.67
Rot. Bonds4

About N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (PubChem CID 27162814) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
PubChem CID27162814
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCc1csc(=O)n1CCC(=O)NC1CCCC1
InChIInChI=1S/C12H18N2O2S/c1-9-8-17-12(16)14(9)7-6-11(15)13-10-4-2-3-5-10/h8,10H,2-7H2,1H3,(H,13,15)
InChIKeyJCDXYMCEFJAIAE-UHFFFAOYSA-N
XLogP1.67
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The IUPAC name of N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (CID 27162814) is N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The canonical SMILES for N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is Cc1csc(=O)n1CCC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The InChIKey is JCDXYMCEFJAIAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-9-8-17-12(16)14(9)7-6-11(15)13-10-4-2-3-5-10/h8,10H,2-7H2,1H3,(H,13,15).
What are the key properties of N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide has a molecular weight of 254.35 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is sourced from PubChem (CID 27162814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).