2-methylquinoline;quinoline-2-carboxamide

C20H17N3O — CID 174829911

IUPAC2-methylquinoline;quinoline-2-carboxamide
SMILESCc1ccc2ccccc2n1.NC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C10H8N2O.C10H9N/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9;1-8-6-7-9-4-2-3-5-10(9)11-8/h1-6H,(H2,11,13);2-7H,1H3
InChIKeyBNPFFWVAASQNNH-UHFFFAOYSA-N
MW315.38 g/mol
LogP3.88
Rot. Bonds1

About 2-methylquinoline;quinoline-2-carboxamide

2-methylquinoline;quinoline-2-carboxamide (PubChem CID 174829911) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is 2-methylquinoline;quinoline-2-carboxamide.

Molecular Properties

Compound Name2-methylquinoline;quinoline-2-carboxamide
PubChem CID174829911
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name2-methylquinoline;quinoline-2-carboxamide
SMILESCc1ccc2ccccc2n1.NC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C10H8N2O.C10H9N/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9;1-8-6-7-9-4-2-3-5-10(9)11-8/h1-6H,(H2,11,13);2-7H,1H3
InChIKeyBNPFFWVAASQNNH-UHFFFAOYSA-N
XLogP3.88
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylquinoline;quinoline-2-carboxamide?
The IUPAC name of 2-methylquinoline;quinoline-2-carboxamide (CID 174829911) is 2-methylquinoline;quinoline-2-carboxamide.
What is the SMILES notation for 2-methylquinoline;quinoline-2-carboxamide?
The canonical SMILES for 2-methylquinoline;quinoline-2-carboxamide is Cc1ccc2ccccc2n1.NC(=O)c1ccc2ccccc2n1.
What is the InChIKey of 2-methylquinoline;quinoline-2-carboxamide?
The InChIKey is BNPFFWVAASQNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O.C10H9N/c11-10(13)9-6-5-7-3-1-2-4-8(7)12-9;1-8-6-7-9-4-2-3-5-10(9)11-8/h1-6H,(H2,11,13);2-7H,1H3.
What are the key properties of 2-methylquinoline;quinoline-2-carboxamide?
2-methylquinoline;quinoline-2-carboxamide has a molecular weight of 315.38 g/mol, XLogP of 3.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylquinoline;quinoline-2-carboxamide is sourced from PubChem (CID 174829911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).