1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine

C12H15N3O — CID 105471316

IUPAC1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine
SMILESCNCc1nc(C)c2cccc(OC)c2n1
InChIInChI=1S/C12H15N3O/c1-8-9-5-4-6-10(16-3)12(9)15-11(14-8)7-13-2/h4-6,13H,7H2,1-3H3
InChIKeyICOXSHLEZNIMKW-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.67
Rot. Bonds3

About 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine

1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine (PubChem CID 105471316) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine
PubChem CID105471316
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine
SMILESCNCc1nc(C)c2cccc(OC)c2n1
InChIInChI=1S/C12H15N3O/c1-8-9-5-4-6-10(16-3)12(9)15-11(14-8)7-13-2/h4-6,13H,7H2,1-3H3
InChIKeyICOXSHLEZNIMKW-UHFFFAOYSA-N
XLogP1.67
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(8-methoxy-4-methylquinazolin-2-yl)methanamine
CID 84777278
1-(8-methoxy-2-methylquinolin-4-yl)-N-methylmethanamine
CID 82449649
2-chloro-8-methoxy-4-methylquinazoline
CID 59199295
8-methoxy-N,N-dimethyl-2-(methylaminomethyl)quinolin-4-amine
CID 82244171
3-ethyl-8-methoxy-2-methylquinolin-4-amine
CID 62203733
2-cyclopropyl-8-methoxy-N-methylquinolin-4-amine
CID 63357697
8-methoxy-2-(methoxymethyl)-N-methylquinolin-4-amine
CID 55062637
1-(8-methoxyquinolin-5-yl)-N-methylmethanamine
CID 16640560
2-ethoxy-8-methoxy-4-methylquinoline
CID 70328444
1-(2-ethyl-6-methoxy-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)-N-methylmethanamine
CID 82451939
4-benzyl-8-methoxy-2-(4-methylphenyl)quinazoline
CID 2147141
4-chloro-8-methoxy-2-methyl-3-propan-2-ylquinoline
CID 62913697

Frequently Asked Questions

What is the IUPAC name of 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine (CID 105471316) is 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine is CNCc1nc(C)c2cccc(OC)c2n1.
What is the InChIKey of 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine?
The InChIKey is ICOXSHLEZNIMKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8-9-5-4-6-10(16-3)12(9)15-11(14-8)7-13-2/h4-6,13H,7H2,1-3H3.
What are the key properties of 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine?
1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine has a molecular weight of 217.27 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-methoxy-4-methylquinazolin-2-yl)-N-methylmethanamine is sourced from PubChem (CID 105471316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).