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

C9H13N3OS — CID 18072813

IUPACN-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
SMILESCc1csc(NC(=O)C2CCCN2)n1
InChIInChI=1S/C9H13N3OS/c1-6-5-14-9(11-6)12-8(13)7-3-2-4-10-7/h5,7,10H,2-4H2,1H3,(H,11,12,13)
InChIKeyKGUZPWXLXTYGHE-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.14
Rot. Bonds2

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

N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide (PubChem CID 18072813) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
PubChem CID18072813
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
SMILESCc1csc(NC(=O)C2CCCN2)n1
InChIInChI=1S/C9H13N3OS/c1-6-5-14-9(11-6)12-8(13)7-3-2-4-10-7/h5,7,10H,2-4H2,1H3,(H,11,12,13)
InChIKeyKGUZPWXLXTYGHE-UHFFFAOYSA-N
XLogP1.14
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 61482477
(2R)-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 103795480
N-[4-(methoxymethyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide
CID 119301038
N-[4-(2-methylphenyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119282737
N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]piperidine-2-carboxamide
CID 119271224
N-(4-methyl-1,3-thiazol-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 110689742
(2R)-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-2-carboxamide
CID 113267552
ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
CID 143608697
N-(4,5-dimethyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 60710833
trans-(1S,3S)-1-N,3-N-bis(4-methyl-1,3-thiazol-2-yl)cyclohexane-1,3-dicarboxamide
CID 52526965
(2R)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-2-carboxamide;dihydrochloride
CID 119839231
N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]piperidine-2-carboxamide
CID 119270252

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide (CID 18072813) is N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide is Cc1csc(NC(=O)C2CCCN2)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide?
The InChIKey is KGUZPWXLXTYGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c1-6-5-14-9(11-6)12-8(13)7-3-2-4-10-7/h5,7,10H,2-4H2,1H3,(H,11,12,13).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide?
N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 18072813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).