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

C12H19N3OS — CID 112702007

IUPAC2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide
SMILESCc1cnc(C(C)NC(=O)C2CCCC2N)s1
InChIInChI=1S/C12H19N3OS/c1-7-6-14-12(17-7)8(2)15-11(16)9-4-3-5-10(9)13/h6,8-10H,3-5,13H2,1-2H3,(H,15,16)
InChIKeyDGGVAMMHMMECLG-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.76
Rot. Bonds3

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

2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 112702007) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID112702007
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide
SMILESCc1cnc(C(C)NC(=O)C2CCCC2N)s1
InChIInChI=1S/C12H19N3OS/c1-7-6-14-12(17-7)8(2)15-11(16)9-4-3-5-10(9)13/h6,8-10H,3-5,13H2,1-2H3,(H,15,16)
InChIKeyDGGVAMMHMMECLG-UHFFFAOYSA-N
XLogP1.76
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 ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclohexane-1-carboxamide
CID 112702025
2-(aminomethyl)-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide
CID 112702848
2-amino-N-[(1R)-1-pyridin-2-ylethyl]cyclopentane-1-carboxamide
CID 81407618
cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
CID 67437509
2-amino-N-[(1S)-1-phenylethyl]cyclopentane-1-carboxamide
CID 64851455
2-amino-N-[(1S)-1-(2-methylphenyl)ethyl]cyclopentane-1-carboxamide
CID 81380549
2-amino-N-(1-thiophen-2-ylethyl)cyclopentane-1-carboxamide
CID 64822918
1-(2-hydroxycyclohexyl)-3-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]urea
CID 111840983
(2S)-2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]propanamide;dihydrochloride
CID 119898126
2-amino-N-(1-thiophen-3-ylethyl)cyclopentane-1-carboxamide
CID 64824650
3-hydroxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]piperidine-1-carboxamide
CID 111841012
2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]cycloheptane-1-carboxamide
CID 81355949

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide (CID 112702007) is 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide is Cc1cnc(C(C)NC(=O)C2CCCC2N)s1.
What is the InChIKey of 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is DGGVAMMHMMECLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-7-6-14-12(17-7)8(2)15-11(16)9-4-3-5-10(9)13/h6,8-10H,3-5,13H2,1-2H3,(H,15,16).
What are the key properties of 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide?
2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 112702007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).