N-carbamoyl-3-methoxythiophene-2-carboxamide

C7H8N2O3S — CID 81128193

IUPACN-carbamoyl-3-methoxythiophene-2-carboxamide
SMILESCOc1ccsc1C(=O)NC(N)=O
InChIInChI=1S/C7H8N2O3S/c1-12-4-2-3-13-5(4)6(10)9-7(8)11/h2-3H,1H3,(H3,8,9,10,11)
InChIKeyJYMHQXPDUDKEDV-UHFFFAOYSA-N
MW200.22 g/mol
LogP0.57
Rot. Bonds2

About N-carbamoyl-3-methoxythiophene-2-carboxamide

N-carbamoyl-3-methoxythiophene-2-carboxamide (PubChem CID 81128193) has the molecular formula C7H8N2O3S and a molecular weight of 200.22 g/mol. Its IUPAC name is N-carbamoyl-3-methoxythiophene-2-carboxamide.

Molecular Properties

Compound NameN-carbamoyl-3-methoxythiophene-2-carboxamide
PubChem CID81128193
Molecular FormulaC7H8N2O3S
Molecular Weight200.22 g/mol
Exact Mass200.03
IUPAC NameN-carbamoyl-3-methoxythiophene-2-carboxamide
SMILESCOc1ccsc1C(=O)NC(N)=O
InChIInChI=1S/C7H8N2O3S/c1-12-4-2-3-13-5(4)6(10)9-7(8)11/h2-3H,1H3,(H3,8,9,10,11)
InChIKeyJYMHQXPDUDKEDV-UHFFFAOYSA-N
XLogP0.57
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.22
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-1-aminopropan-2-yl]-3-methoxythiophene-2-carboxamide
CID 120508214
N-carbamoyl-3-chlorothiophene-2-carboxamide
CID 80642165
N-(1-amino-2-methyl-1-sulfanylidenebutan-2-yl)-3-methoxythiophene-2-carboxamide
CID 81122517
methyl 2-hydroxy-3-[(3-methoxythiophene-2-carbonyl)amino]propanoate
CID 113344178
N-(2-aminophenyl)-3-methoxythiophene-2-carboxamide
CID 81116979
N-(3-chloro-2,2-dimethylpropyl)-3-methoxythiophene-2-carboxamide
CID 115364635
N-[(4-aminophenyl)methyl]-3-methoxythiophene-2-carboxamide
CID 81116990
potassium 3-methoxythiophene-2-carboxylate
CID 172727491
N-but-3-yn-2-yl-3-methoxythiophene-2-carboxamide
CID 114390087
(2S)-2-[(3-methoxythiophene-2-carbonyl)amino]-3-methylbutanoic acid
CID 81126687
N-[2-(chloromethyl)-2-ethylbutyl]-3-methoxythiophene-2-carboxamide
CID 106253944
N-[1-(hydroxymethyl)cyclohexyl]-3-methoxythiophene-2-carboxamide
CID 81122084

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-3-methoxythiophene-2-carboxamide?
The IUPAC name of N-carbamoyl-3-methoxythiophene-2-carboxamide (CID 81128193) is N-carbamoyl-3-methoxythiophene-2-carboxamide.
What is the SMILES notation for N-carbamoyl-3-methoxythiophene-2-carboxamide?
The canonical SMILES for N-carbamoyl-3-methoxythiophene-2-carboxamide is COc1ccsc1C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-3-methoxythiophene-2-carboxamide?
The InChIKey is JYMHQXPDUDKEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3S/c1-12-4-2-3-13-5(4)6(10)9-7(8)11/h2-3H,1H3,(H3,8,9,10,11).
What are the key properties of N-carbamoyl-3-methoxythiophene-2-carboxamide?
N-carbamoyl-3-methoxythiophene-2-carboxamide has a molecular weight of 200.22 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-3-methoxythiophene-2-carboxamide is sourced from PubChem (CID 81128193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).