3-methylquinoline-8-carboxamide

C11H10N2O — CID 25208598

IUPAC3-methylquinoline-8-carboxamide
SMILESCc1cnc2c(C(N)=O)cccc2c1
InChIInChI=1S/C11H10N2O/c1-7-5-8-3-2-4-9(11(12)14)10(8)13-6-7/h2-6H,1H3,(H2,12,14)
InChIKeyBRQFPNHEOMCVCI-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.64
Rot. Bonds1

About 3-methylquinoline-8-carboxamide

3-methylquinoline-8-carboxamide (PubChem CID 25208598) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 3-methylquinoline-8-carboxamide.

Molecular Properties

Compound Name3-methylquinoline-8-carboxamide
PubChem CID25208598
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name3-methylquinoline-8-carboxamide
SMILESCc1cnc2c(C(N)=O)cccc2c1
InChIInChI=1S/C11H10N2O/c1-7-5-8-3-2-4-9(11(12)14)10(8)13-6-7/h2-6H,1H3,(H2,12,14)
InChIKeyBRQFPNHEOMCVCI-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 3-methylquinoline-8-carboxamide?
The IUPAC name of 3-methylquinoline-8-carboxamide (CID 25208598) is 3-methylquinoline-8-carboxamide.
What is the SMILES notation for 3-methylquinoline-8-carboxamide?
The canonical SMILES for 3-methylquinoline-8-carboxamide is Cc1cnc2c(C(N)=O)cccc2c1.
What is the InChIKey of 3-methylquinoline-8-carboxamide?
The InChIKey is BRQFPNHEOMCVCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-7-5-8-3-2-4-9(11(12)14)10(8)13-6-7/h2-6H,1H3,(H2,12,14).
What are the key properties of 3-methylquinoline-8-carboxamide?
3-methylquinoline-8-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 3-methylquinoline-8-carboxamide is sourced from PubChem (CID 25208598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).