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

C16H20N4 — CID 80755891

IUPACN,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
SMILESCNc1cc(N2c3ccccc3CCC2C)nc(C)n1
InChIInChI=1S/C16H20N4/c1-11-8-9-13-6-4-5-7-14(13)20(11)16-10-15(17-3)18-12(2)19-16/h4-7,10-11H,8-9H2,1-3H3,(H,17,18,19)
InChIKeyAKOQPAQWFRXDMT-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.30
Rot. Bonds2

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

N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine (PubChem CID 80755891) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
PubChem CID80755891
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC NameN,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
SMILESCNc1cc(N2c3ccccc3CCC2C)nc(C)n1
InChIInChI=1S/C16H20N4/c1-11-8-9-13-6-4-5-7-14(13)20(11)16-10-15(17-3)18-12(2)19-16/h4-7,10-11H,8-9H2,1-3H3,(H,17,18,19)
InChIKeyAKOQPAQWFRXDMT-UHFFFAOYSA-N
XLogP3.30
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine?
The IUPAC name of N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine (CID 80755891) is N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine?
The canonical SMILES for N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine is CNc1cc(N2c3ccccc3CCC2C)nc(C)n1.
What is the InChIKey of N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine?
The InChIKey is AKOQPAQWFRXDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-11-8-9-13-6-4-5-7-14(13)20(11)16-10-15(17-3)18-12(2)19-16/h4-7,10-11H,8-9H2,1-3H3,(H,17,18,19).
What are the key properties of N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine?
N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine has a molecular weight of 268.36 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 80755891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).