N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide

C10H10N4O2S — CID 17144363

IUPACN-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide
SMILESCn1nccc1C(=O)Nc1sccc1C(N)=O
InChIInChI=1S/C10H10N4O2S/c1-14-7(2-4-12-14)9(16)13-10-6(8(11)15)3-5-17-10/h2-5H,1H3,(H2,11,15)(H,13,16)
InChIKeyPNCVYZAKSKKALI-UHFFFAOYSA-N
MW250.28 g/mol
LogP0.83
Rot. Bonds3

About N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide

N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide (PubChem CID 17144363) has the molecular formula C10H10N4O2S and a molecular weight of 250.28 g/mol. Its IUPAC name is N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide
PubChem CID17144363
Molecular FormulaC10H10N4O2S
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC NameN-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide
SMILESCn1nccc1C(=O)Nc1sccc1C(N)=O
InChIInChI=1S/C10H10N4O2S/c1-14-7(2-4-12-14)9(16)13-10-6(8(11)15)3-5-17-10/h2-5H,1H3,(H2,11,15)(H,13,16)
InChIKeyPNCVYZAKSKKALI-UHFFFAOYSA-N
XLogP0.83
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-pyrazol-1-ylpropan-2-yl)thiophene-3-carboxamide
CID 43074999
N-{2-[3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}thiophene-3-carboxamide
CID 71808003
N-(3-carbamoyl-5-propylthiophen-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
CID 5112472
1,3-dimethyl-N-(3-(methylcarbamoyl)thiophen-2-yl)-1H-pyrazole-5-carboxamide
CID 16952825
methyl 2-(1-ethyl-1H-pyrazole-3-carboxamido)thiophene-3-carboxylate
CID 17144320
N-(3-carbamoylthiophen-2-yl)-1-ethyl-1H-pyrazole-3-carboxamide
CID 17144361
N-(3-cyanothiophen-2-yl)-1-ethyl-1H-pyrazole-3-carboxamide
CID 17144374
N-(3-cyano-2-thienyl)-1-methyl-5-pyrazolecarboxamide
CID 17144376
N-(3-cyanothiophen-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
CID 25843655
1-methyl-N-[3-(methylcarbamoyl)thiophen-2-yl]-1H-pyrazole-3-carboxamide
CID 25843657
N-(3-cyano-2-thienyl)-1-ethyl-5-pyrazolecarboxamide
CID 25854597
N-(3-carbamoyl-2-thienyl)-1-ethyl-5-pyrazolecarboxamide
CID 25854599

Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide?
The IUPAC name of N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide (CID 17144363) is N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide.
What is the SMILES notation for N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide?
The canonical SMILES for N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide is Cn1nccc1C(=O)Nc1sccc1C(N)=O.
What is the InChIKey of N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide?
The InChIKey is PNCVYZAKSKKALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S/c1-14-7(2-4-12-14)9(16)13-10-6(8(11)15)3-5-17-10/h2-5H,1H3,(H2,11,15)(H,13,16).
What are the key properties of N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide?
N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide has a molecular weight of 250.28 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoylthiophen-2-yl)-2-methylpyrazole-3-carboxamide is sourced from PubChem (CID 17144363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).