2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine

C17H18N4 — CID 114755413

IUPAC2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(N)nc(-c2cc(C)c3ccccc3n2)n1
InChIInChI=1S/C17H18N4/c1-3-6-12-10-16(18)21-17(19-12)15-9-11(2)13-7-4-5-8-14(13)20-15/h4-5,7-10H,3,6H2,1-2H3,(H2,18,19,21)
InChIKeyDRFBYNFOHWWHEP-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.53
Rot. Bonds3

About 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine

2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine (PubChem CID 114755413) has the molecular formula C17H18N4 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine
PubChem CID114755413
Molecular FormulaC17H18N4
Molecular Weight278.36 g/mol
Exact Mass278.15
IUPAC Name2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(N)nc(-c2cc(C)c3ccccc3n2)n1
InChIInChI=1S/C17H18N4/c1-3-6-12-10-16(18)21-17(19-12)15-9-11(2)13-7-4-5-8-14(13)20-15/h4-5,7-10H,3,6H2,1-2H3,(H2,18,19,21)
InChIKeyDRFBYNFOHWWHEP-UHFFFAOYSA-N
XLogP3.53
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylquinolin-2-yl)pyrimidin-4-amine
CID 114755416
6-propyl-2-(2,4,6-trimethylphenyl)pyrimidin-4-amine
CID 62202644
4-methyl-6-(4-methylquinolin-2-yl)-1,3,5-triazin-2-amine
CID 114755546
2-(4,6-dichloro-5-ethylpyrimidin-2-yl)-4-methylquinoline
CID 114754592
N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine
CID 114755419
2-hexyl-4-methylquinoline
CID 504074
2-(2,6-dichlorophenyl)-6-propylpyrimidin-4-amine
CID 62202996
4-(4-methylquinolin-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 114755549
2-(2,3-dichlorophenyl)-6-propylpyrimidin-4-amine
CID 62201749
2-[4-chloro-6-(methoxymethyl)pyrimidin-2-yl]-4-methylquinoline
CID 114754588
1-[2-(4-methylquinolin-2-yl)pyrimidin-4-yl]propan-2-amine
CID 114755499
[4-ethyl-2-(4-methylquinolin-2-yl)-1,3-thiazol-5-yl]methanamine
CID 114755452

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine?
The IUPAC name of 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine (CID 114755413) is 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine?
The canonical SMILES for 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine is CCCc1cc(N)nc(-c2cc(C)c3ccccc3n2)n1.
What is the InChIKey of 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine?
The InChIKey is DRFBYNFOHWWHEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4/c1-3-6-12-10-16(18)21-17(19-12)15-9-11(2)13-7-4-5-8-14(13)20-15/h4-5,7-10H,3,6H2,1-2H3,(H2,18,19,21).
What are the key properties of 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine?
2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylquinolin-2-yl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 114755413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).