3-(2-chlorophenyl)-2-methyl-4H-quinazoline

C15H13ClN2 — CID 174924733

IUPAC3-(2-chlorophenyl)-2-methyl-4H-quinazoline
SMILESCC1=Nc2ccccc2CN1c1ccccc1Cl
InChIInChI=1S/C15H13ClN2/c1-11-17-14-8-4-2-6-12(14)10-18(11)15-9-5-3-7-13(15)16/h2-9H,10H2,1H3
InChIKeyFJQGRQZXRKHIJB-UHFFFAOYSA-N
MW256.74 g/mol
LogP4.41
Rot. Bonds1

About 3-(2-chlorophenyl)-2-methyl-4H-quinazoline

3-(2-chlorophenyl)-2-methyl-4H-quinazoline (PubChem CID 174924733) has the molecular formula C15H13ClN2 and a molecular weight of 256.74 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-2-methyl-4H-quinazoline.

Molecular Properties

Compound Name3-(2-chlorophenyl)-2-methyl-4H-quinazoline
PubChem CID174924733
Molecular FormulaC15H13ClN2
Molecular Weight256.74 g/mol
Exact Mass256.08
IUPAC Name3-(2-chlorophenyl)-2-methyl-4H-quinazoline
SMILESCC1=Nc2ccccc2CN1c1ccccc1Cl
InChIInChI=1S/C15H13ClN2/c1-11-17-14-8-4-2-6-12(14)10-18(11)15-9-5-3-7-13(15)16/h2-9H,10H2,1H3
InChIKeyFJQGRQZXRKHIJB-UHFFFAOYSA-N
XLogP4.41
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[4-(2-Chlorophenyl)piperazin-1-yl]methyl]-5-methoxy-2,3-dihydroimidazo[1,2-c]quinazoline
CID 44310453
3-chloro-12-methylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline
CID 18992275
3-[1-(2-Chloro-phenyl)-meth-(E)-ylidene]-1,2,3,9-tetrahydro-pyrrolo[2,1-b]quinazoline
CID 44391171
(3E)-3-[(2-chlorophenyl)methylidene]-1-ethyl-2,9-dihydro-1H-pyrrolo[2,1-b]quinazoline
CID 44391330
3-phenyl-4H-quinazoline;hydrochloride
CID 15945624
2-chloro-12-methylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline
CID 46905532
3-[6-chloro-2-methyl-4-(4-methylphenyl)-4H-quinazolin-3-yl]-N,N-dimethylpropan-1-amine
CID 54669774
3-benzyl-6-chloro-2-methyl-4-phenyl-4H-quinazoline
CID 54757706
3-[(6-chloro-2-methyl-4-phenyl-4H-quinazolin-3-yl)methyl]-N,N-dimethylaniline
CID 54757712
3-(6-chloro-2-methyl-4-phenyl-4H-quinazolin-3-yl)-N,N-dimethylpropan-1-amine
CID 54757898
3-(2-Chlorophenyl)-2-phenylquinazolin-4-imine;hydrochloride
CID 137642932
{3-Chloro-4-[1,2-dihydro-9H-pyrrolo[2,1-b]quinazolin-(3E)-ylidenemethyl]-phenyl}-dimethyl-amine
CID 44391307

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-2-methyl-4H-quinazoline?
The IUPAC name of 3-(2-chlorophenyl)-2-methyl-4H-quinazoline (CID 174924733) is 3-(2-chlorophenyl)-2-methyl-4H-quinazoline.
What is the SMILES notation for 3-(2-chlorophenyl)-2-methyl-4H-quinazoline?
The canonical SMILES for 3-(2-chlorophenyl)-2-methyl-4H-quinazoline is CC1=Nc2ccccc2CN1c1ccccc1Cl.
What is the InChIKey of 3-(2-chlorophenyl)-2-methyl-4H-quinazoline?
The InChIKey is FJQGRQZXRKHIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2/c1-11-17-14-8-4-2-6-12(14)10-18(11)15-9-5-3-7-13(15)16/h2-9H,10H2,1H3.
What are the key properties of 3-(2-chlorophenyl)-2-methyl-4H-quinazoline?
3-(2-chlorophenyl)-2-methyl-4H-quinazoline has a molecular weight of 256.74 g/mol, XLogP of 4.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-2-methyl-4H-quinazoline is sourced from PubChem (CID 174924733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).