N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine

C17H18N4 — CID 63222525

IUPACN-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine
SMILESCCCc1cc(NC)nc(-c2ccc3ccccc3n2)n1
InChIInChI=1S/C17H18N4/c1-3-6-13-11-16(18-2)21-17(19-13)15-10-9-12-7-4-5-8-14(12)20-15/h4-5,7-11H,3,6H2,1-2H3,(H,18,19,21)
InChIKeyCDBWJVDJBSWZAD-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.69
Rot. Bonds4

About N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine

N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine (PubChem CID 63222525) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine
PubChem CID63222525
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC NameN-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine
SMILESCCCc1cc(NC)nc(-c2ccc3ccccc3n2)n1
InChIInChI=1S/C17H18N4/c1-3-6-13-11-16(18-2)21-17(19-13)15-10-9-12-7-4-5-8-14(12)20-15/h4-5,7-11H,3,6H2,1-2H3,(H,18,19,21)
InChIKeyCDBWJVDJBSWZAD-UHFFFAOYSA-N
XLogP3.69
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-propyl-2-quinolin-4-ylpyrimidin-4-amine
CID 63867494
2-(4-fluorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 62191788
6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 62191102
N-methyl-6-propyl-2-pyridin-3-ylpyrimidin-4-amine
CID 62191790
N-methyl-6-quinolin-2-ylpyridin-2-amine
CID 116645331
N-methyl-6-quinolin-2-ylpyrimidin-4-amine
CID 116645319
2-(2,4-dichlorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 63480481
5-bromo-6-propyl-2-quinolin-2-ylpyrimidin-4-amine
CID 66306932
2-(4-bromo-3,5-dimethylphenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 114330950
2-(4-propylphenyl)quinoline
CID 69251676
6-ethyl-N-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 62190207
(2-phenyl-6-propylpyrimidin-4-yl)hydrazine
CID 62252370

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine?
The IUPAC name of N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine (CID 63222525) is N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine?
The canonical SMILES for N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine is CCCc1cc(NC)nc(-c2ccc3ccccc3n2)n1.
What is the InChIKey of N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine?
The InChIKey is CDBWJVDJBSWZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-3-6-13-11-16(18-2)21-17(19-13)15-10-9-12-7-4-5-8-14(12)20-15/h4-5,7-11H,3,6H2,1-2H3,(H,18,19,21).
What are the key properties of N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine?
N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-propyl-2-quinolin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 63222525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).