2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine

C12H14FN3 — CID 105473983

IUPAC2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine
SMILESCNCCc1nc(C)c2cc(F)ccc2n1
InChIInChI=1S/C12H14FN3/c1-8-10-7-9(13)3-4-11(10)16-12(15-8)5-6-14-2/h3-4,7,14H,5-6H2,1-2H3
InChIKeyLFIBKIBVFLKQOW-UHFFFAOYSA-N
MW219.26 g/mol
LogP1.84
Rot. Bonds3

About 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine

2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine (PubChem CID 105473983) has the molecular formula C12H14FN3 and a molecular weight of 219.26 g/mol. Its IUPAC name is 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine
PubChem CID105473983
Molecular FormulaC12H14FN3
Molecular Weight219.26 g/mol
Exact Mass219.12
IUPAC Name2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine
SMILESCNCCc1nc(C)c2cc(F)ccc2n1
InChIInChI=1S/C12H14FN3/c1-8-10-7-9(13)3-4-11(10)16-12(15-8)5-6-14-2/h3-4,7,14H,5-6H2,1-2H3
InChIKeyLFIBKIBVFLKQOW-UHFFFAOYSA-N
XLogP1.84
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chloro-6-methylquinazolin-2-yl)-N-methylethanamine
CID 105497222
2-(7-fluoro-4-methylquinazolin-2-yl)ethanol
CID 105458514
3-(6-fluoro-2-methylquinolin-3-yl)-N-methylpropan-1-amine
CID 82242928
2-[4-(2,4-difluorophenyl)-6-methylpyrimidin-2-yl]-N-methylethanamine
CID 116892653
2-(4-chloroquinazolin-2-yl)-N-methylethanamine
CID 105478665
1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine
CID 105492846
6-fluoro-4-methyl-2-piperidin-1-ylquinazoline
CID 139333383
6-fluoro-N,2-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62913667
4-(4-fluoro-2-methylphenyl)-N-methylbut-3-en-1-amine
CID 79591290
2-[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]-N-methylethanamine
CID 79718495
ethane;6-fluoro-2,4-dimethylquinoline
CID 142222878
(4-ethyl-6-fluoro-2-methylquinolin-3-yl)methanol
CID 125453119

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine?
The IUPAC name of 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine (CID 105473983) is 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine is CNCCc1nc(C)c2cc(F)ccc2n1.
What is the InChIKey of 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine?
The InChIKey is LFIBKIBVFLKQOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c1-8-10-7-9(13)3-4-11(10)16-12(15-8)5-6-14-2/h3-4,7,14H,5-6H2,1-2H3.
What are the key properties of 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine?
2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine has a molecular weight of 219.26 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine is sourced from PubChem (CID 105473983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).