1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide

C12H19N3OS — CID 54953892

IUPAC1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
SMILESCCc1nc(NC(=O)C2(N)CCCC2)sc1C
InChIInChI=1S/C12H19N3OS/c1-3-9-8(2)17-11(14-9)15-10(16)12(13)6-4-5-7-12/h3-7,13H2,1-2H3,(H,14,15,16)
InChIKeyPVLANUKNGWJPEG-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.22
Rot. Bonds3

About 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide

1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide (PubChem CID 54953892) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
PubChem CID54953892
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide
SMILESCCc1nc(NC(=O)C2(N)CCCC2)sc1C
InChIInChI=1S/C12H19N3OS/c1-3-9-8(2)17-11(14-9)15-10(16)12(13)6-4-5-7-12/h3-7,13H2,1-2H3,(H,14,15,16)
InChIKeyPVLANUKNGWJPEG-UHFFFAOYSA-N
XLogP2.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide (CID 54953892) is 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide is CCc1nc(NC(=O)C2(N)CCCC2)sc1C.
What is the InChIKey of 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
The InChIKey is PVLANUKNGWJPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-3-9-8(2)17-11(14-9)15-10(16)12(13)6-4-5-7-12/h3-7,13H2,1-2H3,(H,14,15,16).
What are the key properties of 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide?
1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 54953892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).