1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine

C13H16FN3 — CID 105492846

IUPAC1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1nc(C)nc2ccc(F)cc12
InChIInChI=1S/C13H16FN3/c1-8(15-3)6-13-11-7-10(14)4-5-12(11)16-9(2)17-13/h4-5,7-8,15H,6H2,1-3H3
InChIKeyBNAYETQZGALKOM-UHFFFAOYSA-N
MW233.29 g/mol
LogP2.23
Rot. Bonds3

About 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine

1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine (PubChem CID 105492846) has the molecular formula C13H16FN3 and a molecular weight of 233.29 g/mol. Its IUPAC name is 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine
PubChem CID105492846
Molecular FormulaC13H16FN3
Molecular Weight233.29 g/mol
Exact Mass233.13
IUPAC Name1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1nc(C)nc2ccc(F)cc12
InChIInChI=1S/C13H16FN3/c1-8(15-3)6-13-11-7-10(14)4-5-12(11)16-9(2)17-13/h4-5,7-8,15H,6H2,1-3H3
InChIKeyBNAYETQZGALKOM-UHFFFAOYSA-N
XLogP2.23
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-fluoro-2-methylquinazolin-4-amine
CID 105436760
7-fluoro-4-[2-(methylamino)propyl]-3H-quinazolin-2-one
CID 105496020
1-(2-chloroquinazolin-4-yl)-N-methylpropan-2-amine
CID 105497203
2-(6-fluoro-4-methylquinazolin-2-yl)-N-methylethanamine
CID 105473983
1-(5-fluoro-1H-indol-3-yl)-N-methylpropan-2-amine
CID 117195576
6-fluoro-N,2-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62913667
1-(7-fluoro-2-methylquinazolin-4-yl)ethanamine
CID 105457285
6-fluoro-N-methyl-2-propan-2-ylquinolin-4-amine
CID 62202391
6-fluoro-2-methylquinazoline-4-carboxamide
CID 171383958
1-[5-(5-fluoro-3-methyl-1-benzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]-N-methylpropan-2-amine;hydrochloride
CID 120865361
(2S)-2-[(6-fluoroquinazolin-4-yl)amino]propan-1-ol
CID 133428083
1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine
CID 84733466

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine (CID 105492846) is 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine is CNC(C)Cc1nc(C)nc2ccc(F)cc12.
What is the InChIKey of 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine?
The InChIKey is BNAYETQZGALKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3/c1-8(15-3)6-13-11-7-10(14)4-5-12(11)16-9(2)17-13/h4-5,7-8,15H,6H2,1-3H3.
What are the key properties of 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine?
1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine has a molecular weight of 233.29 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-2-methylquinazolin-4-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 105492846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).