N,N-diethyl-8-fluoroquinazolin-4-amine

C12H14FN3 — CID 110433527

IUPACN,N-diethyl-8-fluoroquinazolin-4-amine
SMILESCCN(CC)c1ncnc2c(F)cccc12
InChIInChI=1S/C12H14FN3/c1-3-16(4-2)12-9-6-5-7-10(13)11(9)14-8-15-12/h5-8H,3-4H2,1-2H3
InChIKeyDHXCZCNEEJCXAF-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.62
Rot. Bonds3

About N,N-diethyl-8-fluoroquinazolin-4-amine

N,N-diethyl-8-fluoroquinazolin-4-amine (PubChem CID 110433527) has the molecular formula C12H14FN3 and a molecular weight of 219.26 g/mol. Its IUPAC name is N,N-diethyl-8-fluoroquinazolin-4-amine.

Molecular Properties

Compound NameN,N-diethyl-8-fluoroquinazolin-4-amine
PubChem CID110433527
Molecular FormulaC12H14FN3
Molecular Weight219.26 g/mol
Exact Mass219.12
IUPAC NameN,N-diethyl-8-fluoroquinazolin-4-amine
SMILESCCN(CC)c1ncnc2c(F)cccc12
InChIInChI=1S/C12H14FN3/c1-3-16(4-2)12-9-6-5-7-10(13)11(9)14-8-15-12/h5-8H,3-4H2,1-2H3
InChIKeyDHXCZCNEEJCXAF-UHFFFAOYSA-N
XLogP2.62
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(8-fluoroquinazolin-4-yl)-methylamino]-2-methylpropanoic acid
CID 122064764
N-ethyl-6,8-difluoro-N-(2-phenylethyl)quinazolin-4-amine
CID 177249467
8-fluoro-4-methylsulfanylquinazoline
CID 130639671
8-fluoro-N-(2-fluorophenyl)quinazolin-4-amine
CID 110434659
8-fluoro-4-[2-(4-propylphenyl)ethoxy]quinazoline
CID 154480659
2-(2,6-difluorophenyl)-N,N-diethylquinazolin-4-amine
CID 59212907
8-fluoro-N-(2,2,2-trifluoroethyl)quinazolin-4-amine
CID 89487428
N-butyl-N-ethylquinazolin-4-amine
CID 110433588
N,N-diethyl-1-(4-fluorophenyl)pyrazolo[5,4-d]pyrimidin-4-amine
CID 7205366
8-fluoro-4-(3,3,3-trifluoropropoxy)quinazoline
CID 67619682
8-bromo-N,N-dimethylquinazolin-4-amine
CID 110433416
N-(2,4-difluorophenyl)-8-fluoroquinazolin-4-amine
CID 110434738

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-8-fluoroquinazolin-4-amine?
The IUPAC name of N,N-diethyl-8-fluoroquinazolin-4-amine (CID 110433527) is N,N-diethyl-8-fluoroquinazolin-4-amine.
What is the SMILES notation for N,N-diethyl-8-fluoroquinazolin-4-amine?
The canonical SMILES for N,N-diethyl-8-fluoroquinazolin-4-amine is CCN(CC)c1ncnc2c(F)cccc12.
What is the InChIKey of N,N-diethyl-8-fluoroquinazolin-4-amine?
The InChIKey is DHXCZCNEEJCXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c1-3-16(4-2)12-9-6-5-7-10(13)11(9)14-8-15-12/h5-8H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-8-fluoroquinazolin-4-amine?
N,N-diethyl-8-fluoroquinazolin-4-amine has a molecular weight of 219.26 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-8-fluoroquinazolin-4-amine is sourced from PubChem (CID 110433527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).