N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide

C17H15N3OS — CID 113016087

IUPACN-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide
SMILESCc1ccccc1Nc1ccc(NC(=O)c2cccs2)cn1
InChIInChI=1S/C17H15N3OS/c1-12-5-2-3-6-14(12)20-16-9-8-13(11-18-16)19-17(21)15-7-4-10-22-15/h2-11H,1H3,(H,18,20)(H,19,21)
InChIKeyHUVJLWHFGPCQPU-UHFFFAOYSA-N
MW309.39 g/mol
LogP4.45
Rot. Bonds4

About N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide

N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide (PubChem CID 113016087) has the molecular formula C17H15N3OS and a molecular weight of 309.39 g/mol. Its IUPAC name is N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide
PubChem CID113016087
Molecular FormulaC17H15N3OS
Molecular Weight309.39 g/mol
Exact Mass309.09
IUPAC NameN-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide
SMILESCc1ccccc1Nc1ccc(NC(=O)c2cccs2)cn1
InChIInChI=1S/C17H15N3OS/c1-12-5-2-3-6-14(12)20-16-9-8-13(11-18-16)19-17(21)15-7-4-10-22-15/h2-11H,1H3,(H,18,20)(H,19,21)
InChIKeyHUVJLWHFGPCQPU-UHFFFAOYSA-N
XLogP4.45
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[4-(diethylamino)-2-methylanilino]-3-pyridinyl]thiophene-2-carboxamide
CID 113022556
N-[5-(2,4-dimethylanilino)-2-pyridinyl]thiophene-2-carboxamide
CID 113031951
N-[6-[4-(trifluoromethyl)anilino]-3-pyridinyl]thiophene-2-carboxamide
CID 113020253
N-[5-(4-chloro-2-methylanilino)-2-pyridinyl]thiophene-2-carboxamide
CID 113033560
N-[6-(3-methoxyanilino)-3-pyridinyl]thiophene-2-carboxamide
CID 113019386
N-[6-(3-chloroanilino)-3-pyridinyl]thiophene-2-carboxamide
CID 113018501
N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide
CID 1449346
N-[6-(2-methylanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113016079
N-[6-(thiophene-2-carbonylamino)-3-pyridinyl]pyridine-4-carboxamide
CID 1449478
N-[5-(2-cyanoanilino)-2-pyridinyl]thiophene-2-carboxamide
CID 113037046
3,4-dimethoxy-N-[6-(2-methylanilino)-3-pyridinyl]benzamide
CID 113016106
N-[5-(3-methylanilino)-2-pyridinyl]thiophene-2-carboxamide
CID 113031418

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide?
The IUPAC name of N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide (CID 113016087) is N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide?
The canonical SMILES for N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide is Cc1ccccc1Nc1ccc(NC(=O)c2cccs2)cn1.
What is the InChIKey of N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide?
The InChIKey is HUVJLWHFGPCQPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3OS/c1-12-5-2-3-6-14(12)20-16-9-8-13(11-18-16)19-17(21)15-7-4-10-22-15/h2-11H,1H3,(H,18,20)(H,19,21).
What are the key properties of N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide?
N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide has a molecular weight of 309.39 g/mol, XLogP of 4.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide is sourced from PubChem (CID 113016087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).