4-amino-7-methylcinnoline-3-carboxamide

C10H10N4O — CID 13169388

IUPAC4-amino-7-methylcinnoline-3-carboxamide
SMILESCc1ccc2c(N)c(C(N)=O)nnc2c1
InChIInChI=1S/C10H10N4O/c1-5-2-3-6-7(4-5)13-14-9(8(6)11)10(12)15/h2-4H,1H3,(H2,11,13)(H2,12,15)
InChIKeyZHCLIRULEKTIOW-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.62
Rot. Bonds1

About 4-amino-7-methylcinnoline-3-carboxamide

4-amino-7-methylcinnoline-3-carboxamide (PubChem CID 13169388) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 4-amino-7-methylcinnoline-3-carboxamide.

Molecular Properties

Compound Name4-amino-7-methylcinnoline-3-carboxamide
PubChem CID13169388
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name4-amino-7-methylcinnoline-3-carboxamide
SMILESCc1ccc2c(N)c(C(N)=O)nnc2c1
InChIInChI=1S/C10H10N4O/c1-5-2-3-6-7(4-5)13-14-9(8(6)11)10(12)15/h2-4H,1H3,(H2,11,13)(H2,12,15)
InChIKeyZHCLIRULEKTIOW-UHFFFAOYSA-N
XLogP0.62
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-7-methylcinnoline-3-carboxamide?
The IUPAC name of 4-amino-7-methylcinnoline-3-carboxamide (CID 13169388) is 4-amino-7-methylcinnoline-3-carboxamide.
What is the SMILES notation for 4-amino-7-methylcinnoline-3-carboxamide?
The canonical SMILES for 4-amino-7-methylcinnoline-3-carboxamide is Cc1ccc2c(N)c(C(N)=O)nnc2c1.
What is the InChIKey of 4-amino-7-methylcinnoline-3-carboxamide?
The InChIKey is ZHCLIRULEKTIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-5-2-3-6-7(4-5)13-14-9(8(6)11)10(12)15/h2-4H,1H3,(H2,11,13)(H2,12,15).
What are the key properties of 4-amino-7-methylcinnoline-3-carboxamide?
4-amino-7-methylcinnoline-3-carboxamide has a molecular weight of 202.22 g/mol, XLogP of 0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-7-methylcinnoline-3-carboxamide is sourced from PubChem (CID 13169388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).