N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide

C11H9ClN2O2S — CID 103719575

IUPACN-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide
SMILESCOc1csc(C(=O)Nc2cccnc2Cl)c1
InChIInChI=1S/C11H9ClN2O2S/c1-16-7-5-9(17-6-7)11(15)14-8-3-2-4-13-10(8)12/h2-6H,1H3,(H,14,15)
InChIKeyFTPJTLCPNDYEPA-UHFFFAOYSA-N
MW268.73 g/mol
LogP3.06
Rot. Bonds3

About N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide

N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide (PubChem CID 103719575) has the molecular formula C11H9ClN2O2S and a molecular weight of 268.73 g/mol. Its IUPAC name is N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide
PubChem CID103719575
Molecular FormulaC11H9ClN2O2S
Molecular Weight268.73 g/mol
Exact Mass268.01
IUPAC NameN-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide
SMILESCOc1csc(C(=O)Nc2cccnc2Cl)c1
InChIInChI=1S/C11H9ClN2O2S/c1-16-7-5-9(17-6-7)11(15)14-8-3-2-4-13-10(8)12/h2-6H,1H3,(H,14,15)
InChIKeyFTPJTLCPNDYEPA-UHFFFAOYSA-N
XLogP3.06
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.73
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2-chloro-3-pyridinyl)-3,4,5-trimethoxybenzamide
CID 3984738
4-chloro-2-[(4-methoxythiophene-2-carbonyl)amino]benzoic acid
CID 81117783
4-chloro-N-(2-chloro-3-pyridinyl)-2-methoxybenzamide
CID 103721934
N-(5-chloro-2-cyanophenyl)-4-methoxythiophene-2-carboxamide
CID 81122801
N-(2-chloro-3-pyridinyl)thiadiazole-5-carboxamide
CID 103622836
2-amino-N-(2-chloro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 62789087
N-(2-chloro-3-pyridinyl)-2-fluoro-6-methoxybenzamide
CID 113265347
2-amino-N-(2-chloro-3-pyridinyl)-6-methoxybenzamide
CID 81421056
N-(2-chloro-5-methoxyphenyl)-4-sulfanylthiophene-2-carboxamide
CID 107026835
N-(2-chloro-3-pyridinyl)-2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 3320057
N-(2-chloro-3-pyridinyl)-2-(methylamino)benzamide
CID 61375906
4-methoxy-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]thiophene-2-carboxamide
CID 161037055

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide?
The IUPAC name of N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide (CID 103719575) is N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide.
What is the SMILES notation for N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide?
The canonical SMILES for N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide is COc1csc(C(=O)Nc2cccnc2Cl)c1.
What is the InChIKey of N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide?
The InChIKey is FTPJTLCPNDYEPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2S/c1-16-7-5-9(17-6-7)11(15)14-8-3-2-4-13-10(8)12/h2-6H,1H3,(H,14,15).
What are the key properties of N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide?
N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide has a molecular weight of 268.73 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-pyridinyl)-4-methoxythiophene-2-carboxamide is sourced from PubChem (CID 103719575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).