1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine

C15H18N4 — CID 170403121

IUPAC1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine
SMILESCc1cnc(NC2CCN(C)c3ccccc32)nc1
InChIInChI=1S/C15H18N4/c1-11-9-16-15(17-10-11)18-13-7-8-19(2)14-6-4-3-5-12(13)14/h3-6,9-10,13H,7-8H2,1-2H3,(H,16,17,18)
InChIKeyAPDQVGHLZSWZQF-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.78
Rot. Bonds2

About 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine

1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine (PubChem CID 170403121) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine
PubChem CID170403121
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine
SMILESCc1cnc(NC2CCN(C)c3ccccc32)nc1
InChIInChI=1S/C15H18N4/c1-11-9-16-15(17-10-11)18-13-7-8-19(2)14-6-4-3-5-12(13)14/h3-6,9-10,13H,7-8H2,1-2H3,(H,16,17,18)
InChIKeyAPDQVGHLZSWZQF-UHFFFAOYSA-N
XLogP2.78
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine?
The IUPAC name of 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine (CID 170403121) is 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine.
What is the SMILES notation for 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine?
The canonical SMILES for 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine is Cc1cnc(NC2CCN(C)c3ccccc32)nc1.
What is the InChIKey of 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine?
The InChIKey is APDQVGHLZSWZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-11-9-16-15(17-10-11)18-13-7-8-19(2)14-6-4-3-5-12(13)14/h3-6,9-10,13H,7-8H2,1-2H3,(H,16,17,18).
What are the key properties of 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine?
1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine has a molecular weight of 254.34 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(5-methylpyrimidin-2-yl)-3,4-dihydro-2H-quinolin-4-amine is sourced from PubChem (CID 170403121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).