N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine

C19H14FN5 — CID 144500782

IUPACN-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine
SMILESCc1cc(Nc2nc(-c3cnccn3)nc3ccccc23)ccc1F
InChIInChI=1S/C19H14FN5/c1-12-10-13(6-7-15(12)20)23-18-14-4-2-3-5-16(14)24-19(25-18)17-11-21-8-9-22-17/h2-11H,1H3,(H,23,24,25)
InChIKeyDVTBFNRMJWPTJP-UHFFFAOYSA-N
MW331.35 g/mol
LogP4.28
Rot. Bonds3

About N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine

N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine (PubChem CID 144500782) has the molecular formula C19H14FN5 and a molecular weight of 331.35 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine
PubChem CID144500782
Molecular FormulaC19H14FN5
Molecular Weight331.35 g/mol
Exact Mass331.12
IUPAC NameN-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine
SMILESCc1cc(Nc2nc(-c3cnccn3)nc3ccccc23)ccc1F
InChIInChI=1S/C19H14FN5/c1-12-10-13(6-7-15(12)20)23-18-14-4-2-3-5-16(14)24-19(25-18)17-11-21-8-9-22-17/h2-11H,1H3,(H,23,24,25)
InChIKeyDVTBFNRMJWPTJP-UHFFFAOYSA-N
XLogP4.28
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.35
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-pyrazin-2-yl-N-[3-(trifluoromethoxy)phenyl]quinazolin-4-amine
CID 71180611
6-chloro-N-(3-chloro-5-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine
CID 144500597
7-bromo-N-(4-fluoro-3-methylphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 144501523
N-(3-fluoro-4-pyridin-4-ylphenyl)-2-pyridin-4-ylquinazolin-4-amine
CID 70789702
N-(3-fluoro-4-methylphenyl)-2-(4-methoxyphenyl)quinazolin-4-amine
CID 20963104
2-(4-fluorophenyl)-N-(4-methylphenyl)quinazolin-4-amine
CID 135058525
N-(3,4-dimethylphenyl)-2-(4-methoxyphenyl)quinazolin-4-amine
CID 20963225
N-(4-chlorophenyl)-2-(6-fluoro-2-pyridinyl)quinazolin-4-amine
CID 23652966
6-iodo-N-methyl-2-pyrazin-2-ylquinazolin-4-amine
CID 67297986
4-N-(3-fluoro-4-methylphenyl)-2-N-methylquinazoline-2,4-diamine
CID 80750621
N-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-pyridin-4-ylquinazolin-4-amine
CID 70789698
6-bromo-N-(3,4-dimethylphenyl)-2-phenylquinazolin-4-amine
CID 23909624

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine (CID 144500782) is N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine is Cc1cc(Nc2nc(-c3cnccn3)nc3ccccc23)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine?
The InChIKey is DVTBFNRMJWPTJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN5/c1-12-10-13(6-7-15(12)20)23-18-14-4-2-3-5-16(14)24-19(25-18)17-11-21-8-9-22-17/h2-11H,1H3,(H,23,24,25).
What are the key properties of N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine?
N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine has a molecular weight of 331.35 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-2-pyrazin-2-ylquinazolin-4-amine is sourced from PubChem (CID 144500782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).