5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine

C15H18N4 — CID 80754656

IUPAC5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine
SMILESCc1ccc2c(c1)CCCN2c1nc(N)ncc1C
InChIInChI=1S/C15H18N4/c1-10-5-6-13-12(8-10)4-3-7-19(13)14-11(2)9-17-15(16)18-14/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,17,18)
InChIKeyOPVIRZHTXCPXDA-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.76
Rot. Bonds1

About 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine

5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine (PubChem CID 80754656) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine
PubChem CID80754656
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine
SMILESCc1ccc2c(c1)CCCN2c1nc(N)ncc1C
InChIInChI=1S/C15H18N4/c1-10-5-6-13-12(8-10)4-3-7-19(13)14-11(2)9-17-15(16)18-14/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,17,18)
InChIKeyOPVIRZHTXCPXDA-UHFFFAOYSA-N
XLogP2.76
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine?
The IUPAC name of 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine (CID 80754656) is 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine?
The canonical SMILES for 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine is Cc1ccc2c(c1)CCCN2c1nc(N)ncc1C.
What is the InChIKey of 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine?
The InChIKey is OPVIRZHTXCPXDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-10-5-6-13-12(8-10)4-3-7-19(13)14-11(2)9-17-15(16)18-14/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,17,18).
What are the key properties of 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine?
5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine has a molecular weight of 254.34 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-amine is sourced from PubChem (CID 80754656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).