N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine

C14H8Cl2FN3 — CID 110434593

IUPACN-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine
SMILESFc1ccc2ncnc(Nc3cc(Cl)ccc3Cl)c2c1
InChIInChI=1S/C14H8Cl2FN3/c15-8-1-3-11(16)13(5-8)20-14-10-6-9(17)2-4-12(10)18-7-19-14/h1-7H,(H,18,19,20)
InChIKeyZJENIGILFLARPC-UHFFFAOYSA-N
MW308.14 g/mol
LogP4.82
Rot. Bonds2

About N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine

N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine (PubChem CID 110434593) has the molecular formula C14H8Cl2FN3 and a molecular weight of 308.14 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine
PubChem CID110434593
Molecular FormulaC14H8Cl2FN3
Molecular Weight308.14 g/mol
Exact Mass307.01
IUPAC NameN-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine
SMILESFc1ccc2ncnc(Nc3cc(Cl)ccc3Cl)c2c1
InChIInChI=1S/C14H8Cl2FN3/c15-8-1-3-11(16)13(5-8)20-14-10-6-9(17)2-4-12(10)18-7-19-14/h1-7H,(H,18,19,20)
InChIKeyZJENIGILFLARPC-UHFFFAOYSA-N
XLogP4.82
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.14
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-6-fluoroquinazolin-4-amine
CID 110434586
N-[(3-chlorophenyl)methyl]-6-fluoroquinazolin-4-amine
CID 78901321
4-N-(2,5-dichlorophenyl)-6-N-(2,4-difluorophenyl)-5-nitropyrimidine-4,6-diamine
CID 22530862
3-[[6-(4-chlorophenyl)quinazolin-4-yl]amino]-2,6-difluorophenol
CID 86766693
N-(4-chloro-2-fluorophenyl)-6-methoxyquinazolin-4-amine
CID 86586464
4-N-(2-chloro-5-fluorophenyl)-5-methoxypyrimidine-4,6-diamine
CID 107531835
4-chloro-2-[(6-methylquinazolin-4-yl)amino]phenol
CID 21002450
4-(2,5-dichloroanilino)quinazolin-5-ol
CID 135830925
6-fluoro-N-quinolin-8-ylquinazolin-4-amine
CID 110434591
4-N-(2-chloro-5-fluorophenyl)-5-methylpyrimidine-4,6-diamine
CID 107531796
4-N-(3-chloro-4-fluorophenyl)quinazoline-4,6-diamine;hydrochloride
CID 21217673
4-N-(4-chloro-2-iodophenyl)quinazoline-4,6-diamine
CID 107634128

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine?
The IUPAC name of N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine (CID 110434593) is N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine.
What is the SMILES notation for N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine?
The canonical SMILES for N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine is Fc1ccc2ncnc(Nc3cc(Cl)ccc3Cl)c2c1.
What is the InChIKey of N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine?
The InChIKey is ZJENIGILFLARPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2FN3/c15-8-1-3-11(16)13(5-8)20-14-10-6-9(17)2-4-12(10)18-7-19-14/h1-7H,(H,18,19,20).
What are the key properties of N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine?
N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine has a molecular weight of 308.14 g/mol, XLogP of 4.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-6-fluoroquinazolin-4-amine is sourced from PubChem (CID 110434593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).