N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide

C10H8ClN3OS — CID 103892877

IUPACN-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1ncsc1C(=O)Nc1ncccc1Cl
InChIInChI=1S/C10H8ClN3OS/c1-6-8(16-5-13-6)10(15)14-9-7(11)3-2-4-12-9/h2-5H,1H3,(H,12,14,15)
InChIKeyNDGHXDDRILKFLQ-UHFFFAOYSA-N
MW253.71 g/mol
LogP2.75
Rot. Bonds2

About N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide

N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 103892877) has the molecular formula C10H8ClN3OS and a molecular weight of 253.71 g/mol. Its IUPAC name is N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID103892877
Molecular FormulaC10H8ClN3OS
Molecular Weight253.71 g/mol
Exact Mass253.01
IUPAC NameN-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1ncsc1C(=O)Nc1ncccc1Cl
InChIInChI=1S/C10H8ClN3OS/c1-6-8(16-5-13-6)10(15)14-9-7(11)3-2-4-12-9/h2-5H,1H3,(H,12,14,15)
InChIKeyNDGHXDDRILKFLQ-UHFFFAOYSA-N
XLogP2.75
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.71
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide
CID 103093844
N-(2,4-dichlorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 54102334
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
CID 103892911
N-(3-chloro-2-pyridinyl)-2,4-dimethylbenzamide
CID 103892998
N-(3-chloro-2-pyridinyl)-2-fluoro-3-methylbenzamide
CID 103943460
2-amino-N-(3-chloro-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 103094302
methyl N-(3-chloro-2-pyridinyl)carbamate
CID 103094493
N-(8-aminoquinolin-5-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 104826457
methyl 4-(2-chlorophenyl)-2-[(4-methyl-1,3-thiazole-5-carbonyl)amino]thiophene-3-carboxylate
CID 71890603
5-chloro-N-(3-chloro-2-pyridinyl)-1,3,4-thiadiazole-2-carboxamide
CID 103094101
4-methyl-N-(4-methyl-2-pyridinyl)-1,3-thiazole-5-carboxamide
CID 47265636
N-[4-chloro-1-[[4-(fluoromethyl)phenyl]methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide
CID 118466724

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide (CID 103892877) is N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide is Cc1ncsc1C(=O)Nc1ncccc1Cl.
What is the InChIKey of N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is NDGHXDDRILKFLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3OS/c1-6-8(16-5-13-6)10(15)14-9-7(11)3-2-4-12-9/h2-5H,1H3,(H,12,14,15).
What are the key properties of N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide?
N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 253.71 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 103892877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).