4-amino-7-methoxycinnoline-3-carboxamide

C10H10N4O2 — CID 13169389

IUPAC4-amino-7-methoxycinnoline-3-carboxamide
SMILESCOc1ccc2c(N)c(C(N)=O)nnc2c1
InChIInChI=1S/C10H10N4O2/c1-16-5-2-3-6-7(4-5)13-14-9(8(6)11)10(12)15/h2-4H,1H3,(H2,11,13)(H2,12,15)
InChIKeyJSPHLIGJWKMDOC-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.32
Rot. Bonds2

About 4-amino-7-methoxycinnoline-3-carboxamide

4-amino-7-methoxycinnoline-3-carboxamide (PubChem CID 13169389) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 4-amino-7-methoxycinnoline-3-carboxamide.

Molecular Properties

Compound Name4-amino-7-methoxycinnoline-3-carboxamide
PubChem CID13169389
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name4-amino-7-methoxycinnoline-3-carboxamide
SMILESCOc1ccc2c(N)c(C(N)=O)nnc2c1
InChIInChI=1S/C10H10N4O2/c1-16-5-2-3-6-7(4-5)13-14-9(8(6)11)10(12)15/h2-4H,1H3,(H2,11,13)(H2,12,15)
InChIKeyJSPHLIGJWKMDOC-UHFFFAOYSA-N
XLogP0.32
TPSA104.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-7-methylcinnoline-3-carboxamide
CID 13169388
4-amino-7-methoxyquinoline-3-carboxylic acid
CID 50877276
2-amino-5-methoxybenzamide;ethane
CID 142071126
4-chloro-6-methoxycinnoline-3-carboxylic acid
CID 83898135
3-bromo-6-methoxyquinoline-2-carboxamide
CID 173087075
1-cyano-4-hydroxy-6-methoxyisoquinoline-3-carboxamide
CID 141385106
6-methoxy-1-methylpyrazolo[5,4-b]quinoline-3-carboxamide
CID 14822502
6-(2-amino-5-methoxyphenoxy)pyridazine-3-carboxamide
CID 102702984
2-(5-methoxy-2H-indazol-3-yl)acetamide
CID 76846209
3-amino-6-methoxy-1-benzothiophene-2-carboxylic acid
CID 57099213
(E)-2-amino-1-(2-amino-4-methoxyphenyl)-3-hydroxyprop-2-en-1-one
CID 156713473
2-amino-5-methoxybenzoic acid;hydrochloride
CID 15618229

Frequently Asked Questions

What is the IUPAC name of 4-amino-7-methoxycinnoline-3-carboxamide?
The IUPAC name of 4-amino-7-methoxycinnoline-3-carboxamide (CID 13169389) is 4-amino-7-methoxycinnoline-3-carboxamide.
What is the SMILES notation for 4-amino-7-methoxycinnoline-3-carboxamide?
The canonical SMILES for 4-amino-7-methoxycinnoline-3-carboxamide is COc1ccc2c(N)c(C(N)=O)nnc2c1.
What is the InChIKey of 4-amino-7-methoxycinnoline-3-carboxamide?
The InChIKey is JSPHLIGJWKMDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-16-5-2-3-6-7(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-methoxycinnoline-3-carboxamide?
4-amino-7-methoxycinnoline-3-carboxamide has a molecular weight of 218.22 g/mol, XLogP of 0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-7-methoxycinnoline-3-carboxamide is sourced from PubChem (CID 13169389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).