N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide

C12H10ClNO2S — CID 107271770

IUPACN-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide
SMILESCOc1cc(NC(=O)c2cccs2)ccc1Cl
InChIInChI=1S/C12H10ClNO2S/c1-16-10-7-8(4-5-9(10)13)14-12(15)11-3-2-6-17-11/h2-7H,1H3,(H,14,15)
InChIKeyRNVBEJGLCCPUTN-UHFFFAOYSA-N
MW267.74 g/mol
LogP3.66
Rot. Bonds3

About N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide

N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide (PubChem CID 107271770) has the molecular formula C12H10ClNO2S and a molecular weight of 267.74 g/mol. Its IUPAC name is N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide
PubChem CID107271770
Molecular FormulaC12H10ClNO2S
Molecular Weight267.74 g/mol
Exact Mass267.01
IUPAC NameN-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide
SMILESCOc1cc(NC(=O)c2cccs2)ccc1Cl
InChIInChI=1S/C12H10ClNO2S/c1-16-10-7-8(4-5-9(10)13)14-12(15)11-3-2-6-17-11/h2-7H,1H3,(H,14,15)
InChIKeyRNVBEJGLCCPUTN-UHFFFAOYSA-N
XLogP3.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.74
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methoxyphenyl)thiophene-2-carboxamide
CID 878235
N-[4-[(3,4-dichlorobenzoyl)amino]-2-methoxyphenyl]thiophene-2-carboxamide
CID 3161499
N-[(3-chloro-4-methoxyphenyl)carbamoyl]thiophene-2-carboxamide
CID 110866426
N-[4-[(3,5-dichloro-4-methoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 1136350
5-[(4-chloro-3-methoxyphenyl)carbamoyl]thiophene-2-carboxylic acid
CID 107622764
N-(4-chloro-2-methoxy-5-methylphenyl)thiophene-2-carboxamide
CID 731690
N-[4-[(5-bromo-2-chlorobenzoyl)carbamothioylamino]-2-methoxyphenyl]thiophene-2-carboxamide
CID 17317061
N-[4-[[2-(4-chlorophenyl)acetyl]amino]-2-methoxyphenyl]thiophene-2-carboxamide
CID 3161370
N-[3-[(3,5-dichloro-2-methoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 4569821
N-[6-(3-chloro-4-methoxyanilino)pyridazin-3-yl]thiophene-2-carboxamide
CID 113047904
N-[4-[(2-bromobenzoyl)amino]-2-methoxyphenyl]thiophene-2-carboxamide
CID 1258183
N-[3-(3-chloro-4-methoxyanilino)-3-oxopropyl]thiophene-2-carboxamide
CID 17497310

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide (CID 107271770) is N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide is COc1cc(NC(=O)c2cccs2)ccc1Cl.
What is the InChIKey of N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide?
The InChIKey is RNVBEJGLCCPUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO2S/c1-16-10-7-8(4-5-9(10)13)14-12(15)11-3-2-6-17-11/h2-7H,1H3,(H,14,15).
What are the key properties of N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide?
N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide has a molecular weight of 267.74 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-methoxyphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 107271770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).