4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine

C15H18N4 — CID 63867150

IUPAC4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine
SMILESCc1ccc(Cc2nc(N)nc(C3CC3)n2)cc1C
InChIInChI=1S/C15H18N4/c1-9-3-4-11(7-10(9)2)8-13-17-14(12-5-6-12)19-15(16)18-13/h3-4,7,12H,5-6,8H2,1-2H3,(H2,16,17,18,19)
InChIKeyDZPKZKKCQYJAJY-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.54
Rot. Bonds3

About 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine

4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine (PubChem CID 63867150) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine
PubChem CID63867150
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine
SMILESCc1ccc(Cc2nc(N)nc(C3CC3)n2)cc1C
InChIInChI=1S/C15H18N4/c1-9-3-4-11(7-10(9)2)8-13-17-14(12-5-6-12)19-15(16)18-13/h3-4,7,12H,5-6,8H2,1-2H3,(H2,16,17,18,19)
InChIKeyDZPKZKKCQYJAJY-UHFFFAOYSA-N
XLogP2.54
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine (CID 63867150) is 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine is Cc1ccc(Cc2nc(N)nc(C3CC3)n2)cc1C.
What is the InChIKey of 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?
The InChIKey is DZPKZKKCQYJAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-9-3-4-11(7-10(9)2)8-13-17-14(12-5-6-12)19-15(16)18-13/h3-4,7,12H,5-6,8H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine?
4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine has a molecular weight of 254.34 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-6-[(3,4-dimethylphenyl)methyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 63867150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).