N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine

C14H9ClFN3 — CID 110434661

IUPACN-(2-chlorophenyl)-8-fluoroquinazolin-4-amine
SMILESFc1cccc2c(Nc3ccccc3Cl)ncnc12
InChIInChI=1S/C14H9ClFN3/c15-10-5-1-2-7-12(10)19-14-9-4-3-6-11(16)13(9)17-8-18-14/h1-8H,(H,17,18,19)
InChIKeyRSIXNMVXKPVOKM-UHFFFAOYSA-N
MW273.70 g/mol
LogP4.17
Rot. Bonds2

About N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine

N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine (PubChem CID 110434661) has the molecular formula C14H9ClFN3 and a molecular weight of 273.70 g/mol. Its IUPAC name is N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-chlorophenyl)-8-fluoroquinazolin-4-amine
PubChem CID110434661
Molecular FormulaC14H9ClFN3
Molecular Weight273.70 g/mol
Exact Mass273.05
IUPAC NameN-(2-chlorophenyl)-8-fluoroquinazolin-4-amine
SMILESFc1cccc2c(Nc3ccccc3Cl)ncnc12
InChIInChI=1S/C14H9ClFN3/c15-10-5-1-2-7-12(10)19-14-9-4-3-6-11(16)13(9)17-8-18-14/h1-8H,(H,17,18,19)
InChIKeyRSIXNMVXKPVOKM-UHFFFAOYSA-N
XLogP4.17
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.70
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-fluoro-N-(2-fluorophenyl)quinazolin-4-amine
CID 110434659
N-(2,4-difluorophenyl)-8-fluoroquinazolin-4-amine
CID 110434738
4-N,6-N-bis(2-chlorophenyl)pyrimidine-4,5,6-triamine
CID 19147893
N-(3,4-difluorophenyl)-8-fluoroquinazolin-4-amine
CID 110434734
8-fluoro-N-(4-propan-2-ylphenyl)quinazolin-4-amine
CID 110434658
4-N-(2-chlorophenyl)-6-N-(4-fluorophenyl)pyrimidine-4,5,6-triamine
CID 19147903
N-(2-chlorophenyl)-7-methylpyrrolo[2,3-d]pyrimidin-4-amine
CID 110875081
8-fluoro-N-(2,2,2-trifluoroethyl)quinazolin-4-amine
CID 89487428
N-(3-chloro-2-fluorophenyl)-6-fluoropyrido[3,4-d]pyrimidin-4-amine
CID 166538319
6-chloro-N-(2,3-difluorophenyl)pyrido[3,4-d]pyrimidin-4-amine
CID 166539805
N-(3-chloro-2-fluorophenyl)thieno[2,3-d]pyrimidin-4-amine
CID 2538570
6-N-(2-chlorophenyl)-4-N-(2,3-dimethylphenyl)pyrimidine-4,5,6-triamine
CID 19143159

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine?
The IUPAC name of N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine (CID 110434661) is N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine.
What is the SMILES notation for N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine?
The canonical SMILES for N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine is Fc1cccc2c(Nc3ccccc3Cl)ncnc12.
What is the InChIKey of N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine?
The InChIKey is RSIXNMVXKPVOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFN3/c15-10-5-1-2-7-12(10)19-14-9-4-3-6-11(16)13(9)17-8-18-14/h1-8H,(H,17,18,19).
What are the key properties of N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine?
N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine has a molecular weight of 273.70 g/mol, XLogP of 4.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-8-fluoroquinazolin-4-amine is sourced from PubChem (CID 110434661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).