N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide

C14H12N4OS — CID 51102512

IUPACN-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
SMILESCc1ccc(-c2cc(NC(=O)c3cccnc3)n[nH]2)s1
InChIInChI=1S/C14H12N4OS/c1-9-4-5-12(20-9)11-7-13(18-17-11)16-14(19)10-3-2-6-15-8-10/h2-8H,1H3,(H2,16,17,18,19)
InChIKeyHQBJZWJXTSQKJC-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.09
Rot. Bonds3

About N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide

N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide (PubChem CID 51102512) has the molecular formula C14H12N4OS and a molecular weight of 284.34 g/mol. Its IUPAC name is N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
PubChem CID51102512
Molecular FormulaC14H12N4OS
Molecular Weight284.34 g/mol
Exact Mass284.07
IUPAC NameN-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
SMILESCc1ccc(-c2cc(NC(=O)c3cccnc3)n[nH]2)s1
InChIInChI=1S/C14H12N4OS/c1-9-4-5-12(20-9)11-7-13(18-17-11)16-14(19)10-3-2-6-15-8-10/h2-8H,1H3,(H2,16,17,18,19)
InChIKeyHQBJZWJXTSQKJC-UHFFFAOYSA-N
XLogP3.09
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 55975946
3-(pyridine-3-carbonylamino)-1H-pyrazole-5-carboxylic acid
CID 64528251
N-[5-(hydroxymethyl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
CID 67819049
N-(5-pentan-2-yl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 71989878
2-imidazol-1-yl-N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]propanamide
CID 56827512
(2S)-2-imidazol-1-yl-N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]propanamide
CID 95599262
N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 4178548
N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
CID 78928131
1-(2-methylphenyl)-N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 56555874
5-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylic acid
CID 28858736
N-(5-pyridin-3-yl-1H-pyrazol-3-yl)acetamide
CID 137321038
3-methyl-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)benzamide
CID 95753070

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide?
The IUPAC name of N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide (CID 51102512) is N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide is Cc1ccc(-c2cc(NC(=O)c3cccnc3)n[nH]2)s1.
What is the InChIKey of N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide?
The InChIKey is HQBJZWJXTSQKJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4OS/c1-9-4-5-12(20-9)11-7-13(18-17-11)16-14(19)10-3-2-6-15-8-10/h2-8H,1H3,(H2,16,17,18,19).
What are the key properties of N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide?
N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide has a molecular weight of 284.34 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 51102512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).