2,4-dimethylquinazoline-7-carboxylic acid

C11H10N2O2 — CID 143096640

IUPAC2,4-dimethylquinazoline-7-carboxylic acid
SMILESCc1nc(C)c2ccc(C(=O)O)cc2n1
InChIInChI=1S/C11H10N2O2/c1-6-9-4-3-8(11(14)15)5-10(9)13-7(2)12-6/h3-5H,1-2H3,(H,14,15)
InChIKeyAOTMLYLPLCMSNG-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.94
Rot. Bonds1

About 2,4-dimethylquinazoline-7-carboxylic acid

2,4-dimethylquinazoline-7-carboxylic acid (PubChem CID 143096640) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 2,4-dimethylquinazoline-7-carboxylic acid.

Molecular Properties

Compound Name2,4-dimethylquinazoline-7-carboxylic acid
PubChem CID143096640
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name2,4-dimethylquinazoline-7-carboxylic acid
SMILESCc1nc(C)c2ccc(C(=O)O)cc2n1
InChIInChI=1S/C11H10N2O2/c1-6-9-4-3-8(11(14)15)5-10(9)13-7(2)12-6/h3-5H,1-2H3,(H,14,15)
InChIKeyAOTMLYLPLCMSNG-UHFFFAOYSA-N
XLogP1.94
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-methylquinoline-7-carboxylic acid
CID 14359530
4-methyl-2-(4-sulfamoylanilino)quinazoline-7-carboxylic acid
CID 67080801
3-ethyl-2,4-dimethylquinoline-6-carboxylic acid
CID 50888886
4-chloro-2-ethylquinoline-7-carboxylic acid
CID 126753847
2,4-dimethyl-N-phenylquinazolin-7-amine
CID 175557011
4-amino-2-methylquinoline-6-carboxylic acid;hydrochloride
CID 139269662
(4-methyl-2-phenylquinazolin-7-yl)-piperidin-1-ylmethanone
CID 146476155
4-methylquinazoline-6-carboxylic acid
CID 84661394
3,10,13,20,23,30-hexazaheptacyclo[20.8.0.02,11.04,9.012,21.014,19.024,29]triaconta-1(30),2,4(9),5,7,10,12,14(19),15,17,20,22,24(29),25,27-pentadecaene-6,16,26-tricarboxylic acid;hexakis(yttrium)
CID 91866629
4-methylquinoline-6-carboxylic acid;hydrochloride
CID 71811102
2-methyl-4-[(3S)-3-methylpiperidin-1-yl]quinoline-7-carboxylic acid
CID 7138041
4-[4-(dimethylamino)anilino]-2-methylquinoline-7-carboxylic acid
CID 7138098

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylquinazoline-7-carboxylic acid?
The IUPAC name of 2,4-dimethylquinazoline-7-carboxylic acid (CID 143096640) is 2,4-dimethylquinazoline-7-carboxylic acid.
What is the SMILES notation for 2,4-dimethylquinazoline-7-carboxylic acid?
The canonical SMILES for 2,4-dimethylquinazoline-7-carboxylic acid is Cc1nc(C)c2ccc(C(=O)O)cc2n1.
What is the InChIKey of 2,4-dimethylquinazoline-7-carboxylic acid?
The InChIKey is AOTMLYLPLCMSNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-6-9-4-3-8(11(14)15)5-10(9)13-7(2)12-6/h3-5H,1-2H3,(H,14,15).
What are the key properties of 2,4-dimethylquinazoline-7-carboxylic acid?
2,4-dimethylquinazoline-7-carboxylic acid has a molecular weight of 202.21 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylquinazoline-7-carboxylic acid is sourced from PubChem (CID 143096640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).