1-methyl-2H-quinazoline

C9H10N2 — CID 58757197

IUPAC1-methyl-2H-quinazoline
SMILESCN1CN=Cc2ccccc21
InChIInChI=1S/C9H10N2/c1-11-7-10-6-8-4-2-3-5-9(8)11/h2-6H,7H2,1H3
InChIKeyZSMCRLMRNSQVRO-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.51
Rot. Bonds

About 1-methyl-2H-quinazoline

1-methyl-2H-quinazoline (PubChem CID 58757197) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 1-methyl-2H-quinazoline.

Molecular Properties

Compound Name1-methyl-2H-quinazoline
PubChem CID58757197
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name1-methyl-2H-quinazoline
SMILESCN1CN=Cc2ccccc21
InChIInChI=1S/C9H10N2/c1-11-7-10-6-8-4-2-3-5-9(8)11/h2-6H,7H2,1H3
InChIKeyZSMCRLMRNSQVRO-UHFFFAOYSA-N
XLogP1.51
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2H-quinazoline?
The IUPAC name of 1-methyl-2H-quinazoline (CID 58757197) is 1-methyl-2H-quinazoline.
What is the SMILES notation for 1-methyl-2H-quinazoline?
The canonical SMILES for 1-methyl-2H-quinazoline is CN1CN=Cc2ccccc21.
What is the InChIKey of 1-methyl-2H-quinazoline?
The InChIKey is ZSMCRLMRNSQVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-11-7-10-6-8-4-2-3-5-9(8)11/h2-6H,7H2,1H3.
What are the key properties of 1-methyl-2H-quinazoline?
1-methyl-2H-quinazoline has a molecular weight of 146.19 g/mol, XLogP of 1.51, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2H-quinazoline is sourced from PubChem (CID 58757197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).