4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine

C20H22N4O — CID 71542895

IUPAC4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine
SMILESCOc1ccc2c(c1)CCCN2c1nc(N(C)C)nc2ccccc12
InChIInChI=1S/C20H22N4O/c1-23(2)20-21-17-9-5-4-8-16(17)19(22-20)24-12-6-7-14-13-15(25-3)10-11-18(14)24/h4-5,8-11,13H,6-7,12H2,1-3H3
InChIKeyNWCWAGJWXUABET-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.79
Rot. Bonds3

About 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine

4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine (PubChem CID 71542895) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine.

Molecular Properties

Compound Name4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine
PubChem CID71542895
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine
SMILESCOc1ccc2c(c1)CCCN2c1nc(N(C)C)nc2ccccc12
InChIInChI=1S/C20H22N4O/c1-23(2)20-21-17-9-5-4-8-16(17)19(22-20)24-12-6-7-14-13-15(25-3)10-11-18(14)24/h4-5,8-11,13H,6-7,12H2,1-3H3
InChIKeyNWCWAGJWXUABET-UHFFFAOYSA-N
XLogP3.79
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine?
The IUPAC name of 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine (CID 71542895) is 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine.
What is the SMILES notation for 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine?
The canonical SMILES for 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine is COc1ccc2c(c1)CCCN2c1nc(N(C)C)nc2ccccc12.
What is the InChIKey of 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine?
The InChIKey is NWCWAGJWXUABET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-23(2)20-21-17-9-5-4-8-16(17)19(22-20)24-12-6-7-14-13-15(25-3)10-11-18(14)24/h4-5,8-11,13H,6-7,12H2,1-3H3.
What are the key properties of 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine?
4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine has a molecular weight of 334.42 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylquinazolin-2-amine is sourced from PubChem (CID 71542895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).