5-chloro-6-methyl-N-phenylquinazolin-2-amine

C15H12ClN3 — CID 70864218

IUPAC5-chloro-6-methyl-N-phenylquinazolin-2-amine
SMILESCc1ccc2nc(Nc3ccccc3)ncc2c1Cl
InChIInChI=1S/C15H12ClN3/c1-10-7-8-13-12(14(10)16)9-17-15(19-13)18-11-5-3-2-4-6-11/h2-9H,1H3,(H,17,18,19)
InChIKeyBHDRUUXBCJPVDJ-UHFFFAOYSA-N
MW269.74 g/mol
LogP4.34
Rot. Bonds2

About 5-chloro-6-methyl-N-phenylquinazolin-2-amine

5-chloro-6-methyl-N-phenylquinazolin-2-amine (PubChem CID 70864218) has the molecular formula C15H12ClN3 and a molecular weight of 269.74 g/mol. Its IUPAC name is 5-chloro-6-methyl-N-phenylquinazolin-2-amine.

Molecular Properties

Compound Name5-chloro-6-methyl-N-phenylquinazolin-2-amine
PubChem CID70864218
Molecular FormulaC15H12ClN3
Molecular Weight269.74 g/mol
Exact Mass269.07
IUPAC Name5-chloro-6-methyl-N-phenylquinazolin-2-amine
SMILESCc1ccc2nc(Nc3ccccc3)ncc2c1Cl
InChIInChI=1S/C15H12ClN3/c1-10-7-8-13-12(14(10)16)9-17-15(19-13)18-11-5-3-2-4-6-11/h2-9H,1H3,(H,17,18,19)
InChIKeyBHDRUUXBCJPVDJ-UHFFFAOYSA-N
XLogP4.34
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.74
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-4-N-(2-methylphenyl)-2-N-phenylpyrimidine-2,4-diamine
CID 155665811
5-chloro-4-N-methyl-2-N-phenylpyrimidine-2,4-diamine
CID 71458913
carbanide;ethane;5-methyl-2-N,4-N-diphenylpyrimidine-2,4-diamine;yttrium
CID 157300828
(2-anilino-6-methoxyquinazolin-5-yl) acetate
CID 141179962
bis(4-chloro-6-methyl-N-phenyl-1,3,5-triazin-2-amine);ethane
CID 159104924
5-methyl-N-phenyl-4-pyridin-4-ylpyrimidin-2-amine
CID 70484958
2-N-[4-[(E)-2-[4-[(4-anilino-1,3,5-triazin-2-yl)amino]-2-methylphenyl]ethenyl]-3-methylphenyl]-4-N-phenyl-1,3,5-triazine-2,4-diamine
CID 58933271
6-chloro-N-phenylpyrido[2,3-d]pyrimidin-2-amine
CID 58499150
5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine
CID 175235509
2-N-(5-chloro-2-methylphenyl)-4-N-phenylquinazoline-2,4-diamine
CID 71690554
7-(5-chloro-2-methylphenyl)-6-methyl-N-phenyl-1,2,4-benzotriazin-3-amine
CID 141186731
CID 172854912
CID 172854912

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-methyl-N-phenylquinazolin-2-amine?
The IUPAC name of 5-chloro-6-methyl-N-phenylquinazolin-2-amine (CID 70864218) is 5-chloro-6-methyl-N-phenylquinazolin-2-amine.
What is the SMILES notation for 5-chloro-6-methyl-N-phenylquinazolin-2-amine?
The canonical SMILES for 5-chloro-6-methyl-N-phenylquinazolin-2-amine is Cc1ccc2nc(Nc3ccccc3)ncc2c1Cl.
What is the InChIKey of 5-chloro-6-methyl-N-phenylquinazolin-2-amine?
The InChIKey is BHDRUUXBCJPVDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3/c1-10-7-8-13-12(14(10)16)9-17-15(19-13)18-11-5-3-2-4-6-11/h2-9H,1H3,(H,17,18,19).
What are the key properties of 5-chloro-6-methyl-N-phenylquinazolin-2-amine?
5-chloro-6-methyl-N-phenylquinazolin-2-amine has a molecular weight of 269.74 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-methyl-N-phenylquinazolin-2-amine is sourced from PubChem (CID 70864218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).