2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine

C14H18N4 — CID 96662102

IUPAC2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine
SMILESCc1nc(CCN)nc(CCc2ccccc2)n1
InChIInChI=1S/C14H18N4/c1-11-16-13(18-14(17-11)9-10-15)8-7-12-5-3-2-4-6-12/h2-6H,7-10,15H2,1H3
InChIKeyDNCLTNMJYHNATQ-UHFFFAOYSA-N
MW242.33 g/mol
LogP1.47
Rot. Bonds5

About 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine

2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine (PubChem CID 96662102) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine
PubChem CID96662102
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine
SMILESCc1nc(CCN)nc(CCc2ccccc2)n1
InChIInChI=1S/C14H18N4/c1-11-16-13(18-14(17-11)9-10-15)8-7-12-5-3-2-4-6-12/h2-6H,7-10,15H2,1H3
InChIKeyDNCLTNMJYHNATQ-UHFFFAOYSA-N
XLogP1.47
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4,6-dimethyl-2-(2-phenylethyl)pyrimidin-5-yl]ethanamine
CID 62746647
2-[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 61335871
2-[4-[(4-fluorophenyl)methyl]-6-methyl-1,3,5-triazin-2-yl]ethanamine
CID 82479364
2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
azane;2-phenylethanamine
CID 23506485
2-benzyl-4,6-dimethyl-1,3,5-triazine
CID 118594943
2-[4-(4-bromophenyl)-6-methyl-1,3,5-triazin-2-yl]ethanamine
CID 82489865
5-iodo-N,6-dimethyl-2-(2-phenylethyl)pyrimidin-4-amine
CID 66306895
3-[3-(2-phenylethyl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 16767874
5-bromo-N,6-dimethyl-2-(2-phenylethyl)pyrimidin-4-amine
CID 66305262
5-methyl-2-(2-phenylethyl)pyrimidin-4-amine
CID 11608193
4-methoxy-6-methyl-2-(2-phenylethyl)pyrimidine
CID 13302362

Frequently Asked Questions

What is the IUPAC name of 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine?
The IUPAC name of 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine (CID 96662102) is 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine.
What is the SMILES notation for 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine?
The canonical SMILES for 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine is Cc1nc(CCN)nc(CCc2ccccc2)n1.
What is the InChIKey of 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine?
The InChIKey is DNCLTNMJYHNATQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-11-16-13(18-14(17-11)9-10-15)8-7-12-5-3-2-4-6-12/h2-6H,7-10,15H2,1H3.
What are the key properties of 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine?
2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine has a molecular weight of 242.33 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methyl-6-(2-phenylethyl)-1,3,5-triazin-2-yl]ethanamine is sourced from PubChem (CID 96662102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).