N-(3-chlorophenyl)-6-ethylquinazolin-4-amine

C16H14ClN3 — CID 21002612

IUPACN-(3-chlorophenyl)-6-ethylquinazolin-4-amine
SMILESCCc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C16H14ClN3/c1-2-11-6-7-15-14(8-11)16(19-10-18-15)20-13-5-3-4-12(17)9-13/h3-10H,2H2,1H3,(H,18,19,20)
InChIKeyABXCBMDXPKKSKK-UHFFFAOYSA-N
MW283.76 g/mol
LogP4.59
Rot. Bonds3

About N-(3-chlorophenyl)-6-ethylquinazolin-4-amine

N-(3-chlorophenyl)-6-ethylquinazolin-4-amine (PubChem CID 21002612) has the molecular formula C16H14ClN3 and a molecular weight of 283.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-ethylquinazolin-4-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-ethylquinazolin-4-amine
PubChem CID21002612
Molecular FormulaC16H14ClN3
Molecular Weight283.76 g/mol
Exact Mass283.09
IUPAC NameN-(3-chlorophenyl)-6-ethylquinazolin-4-amine
SMILESCCc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C16H14ClN3/c1-2-11-6-7-15-14(8-11)16(19-10-18-15)20-13-5-3-4-12(17)9-13/h3-10H,2H2,1H3,(H,18,19,20)
InChIKeyABXCBMDXPKKSKK-UHFFFAOYSA-N
XLogP4.59
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[(6-ethylquinazolin-4-yl)amino]phenyl]ethanone
CID 21002622
6-bromo-N-(3-chlorophenyl)quinazolin-4-amine
CID 720635
7-chloro-N-(3-chlorophenyl)quinazolin-4-amine
CID 1475054
N-(3-chlorophenyl)-6-(6-chloro-3-pyridinyl)quinazolin-4-amine
CID 87720726
N-[(4-chlorophenyl)methyl]-6-ethylquinazolin-4-amine
CID 21002588
N-(3-chlorophenyl)pyrido[4,3-d]pyrimidin-4-amine
CID 22460895
4-N-(3-chlorophenyl)quinazoline-4,7-diamine
CID 5328193
6,7-diethoxy-N-(3-ethylphenyl)quinazolin-4-amine;hydrochloride
CID 68570553
N-(3-chlorophenyl)-7-methoxy-6-methylquinazolin-4-amine
CID 163979167
6-N-(4-butylphenyl)-4-N-(3-chlorophenyl)pyrimidine-4,5,6-triamine
CID 22540062
N-(3-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
CID 118736892
N-[4-(3-chloroanilino)quinazolin-6-yl]-3,4-diethoxybenzamide
CID 146946385

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-ethylquinazolin-4-amine?
The IUPAC name of N-(3-chlorophenyl)-6-ethylquinazolin-4-amine (CID 21002612) is N-(3-chlorophenyl)-6-ethylquinazolin-4-amine.
What is the SMILES notation for N-(3-chlorophenyl)-6-ethylquinazolin-4-amine?
The canonical SMILES for N-(3-chlorophenyl)-6-ethylquinazolin-4-amine is CCc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1.
What is the InChIKey of N-(3-chlorophenyl)-6-ethylquinazolin-4-amine?
The InChIKey is ABXCBMDXPKKSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3/c1-2-11-6-7-15-14(8-11)16(19-10-18-15)20-13-5-3-4-12(17)9-13/h3-10H,2H2,1H3,(H,18,19,20).
What are the key properties of N-(3-chlorophenyl)-6-ethylquinazolin-4-amine?
N-(3-chlorophenyl)-6-ethylquinazolin-4-amine has a molecular weight of 283.76 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-ethylquinazolin-4-amine is sourced from PubChem (CID 21002612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).