4-methylquinoline-5-carboxamide

C11H10N2O — CID 21338712

IUPAC4-methylquinoline-5-carboxamide
SMILESCc1ccnc2cccc(C(N)=O)c12
InChIInChI=1S/C11H10N2O/c1-7-5-6-13-9-4-2-3-8(10(7)9)11(12)14/h2-6H,1H3,(H2,12,14)
InChIKeySVLQYFGNOWJIJW-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.64
Rot. Bonds1

About 4-methylquinoline-5-carboxamide

4-methylquinoline-5-carboxamide (PubChem CID 21338712) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 4-methylquinoline-5-carboxamide.

Molecular Properties

Compound Name4-methylquinoline-5-carboxamide
PubChem CID21338712
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name4-methylquinoline-5-carboxamide
SMILESCc1ccnc2cccc(C(N)=O)c12
InChIInChI=1S/C11H10N2O/c1-7-5-6-13-9-4-2-3-8(10(7)9)11(12)14/h2-6H,1H3,(H2,12,14)
InChIKeySVLQYFGNOWJIJW-UHFFFAOYSA-N
XLogP1.64
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methylquinoline-5-carboxamide?
The IUPAC name of 4-methylquinoline-5-carboxamide (CID 21338712) is 4-methylquinoline-5-carboxamide.
What is the SMILES notation for 4-methylquinoline-5-carboxamide?
The canonical SMILES for 4-methylquinoline-5-carboxamide is Cc1ccnc2cccc(C(N)=O)c12.
What is the InChIKey of 4-methylquinoline-5-carboxamide?
The InChIKey is SVLQYFGNOWJIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-7-5-6-13-9-4-2-3-8(10(7)9)11(12)14/h2-6H,1H3,(H2,12,14).
What are the key properties of 4-methylquinoline-5-carboxamide?
4-methylquinoline-5-carboxamide has a molecular weight of 186.21 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylquinoline-5-carboxamide is sourced from PubChem (CID 21338712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).