2-chloro-5-fluoroquinazolin-4-amine

C8H5ClFN3 — CID 34181642

IUPAC2-chloro-5-fluoroquinazolin-4-amine
SMILESNc1nc(Cl)nc2cccc(F)c12
InChIInChI=1S/C8H5ClFN3/c9-8-12-5-3-1-2-4(10)6(5)7(11)13-8/h1-3H,(H2,11,12,13)
InChIKeyRPIARPIILZFYLF-UHFFFAOYSA-N
MW197.60 g/mol
LogP2.00
Rot. Bonds

About 2-chloro-5-fluoroquinazolin-4-amine

2-chloro-5-fluoroquinazolin-4-amine (PubChem CID 34181642) has the molecular formula C8H5ClFN3 and a molecular weight of 197.60 g/mol. Its IUPAC name is 2-chloro-5-fluoroquinazolin-4-amine.

Molecular Properties

Compound Name2-chloro-5-fluoroquinazolin-4-amine
PubChem CID34181642
Molecular FormulaC8H5ClFN3
Molecular Weight197.60 g/mol
Exact Mass197.02
IUPAC Name2-chloro-5-fluoroquinazolin-4-amine
SMILESNc1nc(Cl)nc2cccc(F)c12
InChIInChI=1S/C8H5ClFN3/c9-8-12-5-3-1-2-4(10)6(5)7(11)13-8/h1-3H,(H2,11,12,13)
InChIKeyRPIARPIILZFYLF-UHFFFAOYSA-N
XLogP2.00
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.60
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloroquinazolin-4-amine
CID 34181658
2-chloro-5-phenylquinazolin-4-amine
CID 141301329
2-cyclopropyl-5-fluoroquinazolin-4-amine
CID 103624115
2-chloro-5-fluoro-8-methylquinazolin-4-amine
CID 130051304
4,5-difluoro-2-methylquinazoline
CID 141141506
4-chloro-2-(chloromethyl)-5-fluoroquinazoline
CID 87480846
tert-butyl 2-(2-chloro-5-fluoroquinazolin-4-yl)acetate
CID 57481567
3,4,5-trifluoro-2-methylquinoline
CID 54570448
5-(3,4-difluorophenyl)quinazoline-2,4-diamine
CID 175913106
2-chlorobenzo[g]quinazolin-4-amine
CID 134830361
5-fluorocinnolin-4-amine
CID 169496265
(4-chloro-5-fluoro-2-methylquinolin-3-yl)methanol
CID 58125399

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoroquinazolin-4-amine?
The IUPAC name of 2-chloro-5-fluoroquinazolin-4-amine (CID 34181642) is 2-chloro-5-fluoroquinazolin-4-amine.
What is the SMILES notation for 2-chloro-5-fluoroquinazolin-4-amine?
The canonical SMILES for 2-chloro-5-fluoroquinazolin-4-amine is Nc1nc(Cl)nc2cccc(F)c12.
What is the InChIKey of 2-chloro-5-fluoroquinazolin-4-amine?
The InChIKey is RPIARPIILZFYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClFN3/c9-8-12-5-3-1-2-4(10)6(5)7(11)13-8/h1-3H,(H2,11,12,13).
What are the key properties of 2-chloro-5-fluoroquinazolin-4-amine?
2-chloro-5-fluoroquinazolin-4-amine has a molecular weight of 197.60 g/mol, XLogP of 2.00, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-fluoroquinazolin-4-amine is sourced from PubChem (CID 34181642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).