4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline

C15H12ClN3 — CID 165083752

IUPAC4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline
SMILESCc1cc2nc(-c3ccncc3)nc(Cl)c2cc1C
InChIInChI=1S/C15H12ClN3/c1-9-7-12-13(8-10(9)2)18-15(19-14(12)16)11-3-5-17-6-4-11/h3-8H,1-2H3
InChIKeyZBAOJMAFLYQOMJ-UHFFFAOYSA-N
MW269.74 g/mol
LogP3.96
Rot. Bonds1

About 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline

4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline (PubChem CID 165083752) has the molecular formula C15H12ClN3 and a molecular weight of 269.74 g/mol. Its IUPAC name is 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline.

Molecular Properties

Compound Name4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline
PubChem CID165083752
Molecular FormulaC15H12ClN3
Molecular Weight269.74 g/mol
Exact Mass269.07
IUPAC Name4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline
SMILESCc1cc2nc(-c3ccncc3)nc(Cl)c2cc1C
InChIInChI=1S/C15H12ClN3/c1-9-7-12-13(8-10(9)2)18-15(19-14(12)16)11-3-5-17-6-4-11/h3-8H,1-2H3
InChIKeyZBAOJMAFLYQOMJ-UHFFFAOYSA-N
XLogP3.96
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.74
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,6-dichloro-5-methyl-2-pyridin-4-ylpyrimidine
CID 63612812
4-chloro-7-fluoro-6-methyl-2-phenylquinazoline
CID 114591614
4-chloro-6,7-dimethoxy-2-pyridin-3-ylquinazoline
CID 15284500
6-bromo-4-chloro-7-fluoro-2-(4-methylphenyl)quinazoline
CID 114591279
4-chloro-7-fluoro-2-(3-fluoro-5-methylphenyl)-6-methylquinazoline
CID 114591652
4-chloro-2-(2,6-difluorophenyl)-7-fluoro-6-methylquinazoline
CID 114591658
4-chloro-6-fluoro-2-(3-fluoro-4-methylphenyl)quinazoline
CID 63084490
4-chloro-2-(2-chlorophenyl)-7-fluoro-6-methylquinazoline
CID 114591625
4-chloro-6,7-dimethoxy-2-(3-methoxyphenyl)quinazoline
CID 57328585
4-chloro-2-(3-chloro-4-methylphenyl)-6-fluoroquinazoline
CID 63498026
4-chloro-2-phenyl-6-propan-2-ylquinazoline
CID 114590616
4-chloro-2-(3-chloro-4-methylphenyl)quinazoline
CID 55197160

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline?
The IUPAC name of 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline (CID 165083752) is 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline.
What is the SMILES notation for 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline?
The canonical SMILES for 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline is Cc1cc2nc(-c3ccncc3)nc(Cl)c2cc1C.
What is the InChIKey of 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline?
The InChIKey is ZBAOJMAFLYQOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3/c1-9-7-12-13(8-10(9)2)18-15(19-14(12)16)11-3-5-17-6-4-11/h3-8H,1-2H3.
What are the key properties of 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline?
4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline has a molecular weight of 269.74 g/mol, XLogP of 3.96, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6,7-dimethyl-2-pyridin-4-ylquinazoline is sourced from PubChem (CID 165083752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).