5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine

C14H17N3 — CID 83265107

IUPAC5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine
SMILESCc1cnc(NC(C)c2ccccc2)cc1N
InChIInChI=1S/C14H17N3/c1-10-9-16-14(8-13(10)15)17-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H3,15,16,17)
InChIKeyMQEXGKKJHYUQJV-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.15
Rot. Bonds3

About 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine

5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine (PubChem CID 83265107) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine.

Molecular Properties

Compound Name5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine
PubChem CID83265107
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine
SMILESCc1cnc(NC(C)c2ccccc2)cc1N
InChIInChI=1S/C14H17N3/c1-10-9-16-14(8-13(10)15)17-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H3,15,16,17)
InChIKeyMQEXGKKJHYUQJV-UHFFFAOYSA-N
XLogP3.15
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine
CID 83266097
5-methyl-2-N-(1-thiophen-3-ylethyl)pyridine-2,4-diamine
CID 83265635
2-[(4-amino-5-methyl-2-pyridinyl)amino]-3-phenylpropan-1-ol
CID 83265448
5-chloro-N-[(1S)-1-phenylethyl]pyrazin-2-amine
CID 142671286
6-N-(2,6-dimethylphenyl)-4-N-(1-phenylethyl)pyrimidine-4,6-diamine
CID 112859346
2-N-(1-phenylethyl)pyrazine-2,6-diamine
CID 78988844
4-N-(1-phenylethyl)pyrimidine-2,4,6-triamine
CID 80769538
2-N-[4-(dimethylamino)butan-2-yl]-5-methylpyridine-2,4-diamine
CID 83265237
3-methyl-1-(2-methylphenyl)-N-[(1S)-1-phenylethyl]pyrazolo[4,3-c]pyridin-6-amine
CID 25093244
2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
CID 113406565
2-N-[1-(4-methylphenyl)ethyl]pyrazine-2,5-diamine
CID 80652605
5-bromo-N-[1-(3-bromophenyl)ethyl]-4-methylpyridin-2-amine
CID 114869184

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine?
The IUPAC name of 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine (CID 83265107) is 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine.
What is the SMILES notation for 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine?
The canonical SMILES for 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine is Cc1cnc(NC(C)c2ccccc2)cc1N.
What is the InChIKey of 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine?
The InChIKey is MQEXGKKJHYUQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-9-16-14(8-13(10)15)17-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H3,15,16,17).
What are the key properties of 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine?
5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine has a molecular weight of 227.31 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine is sourced from PubChem (CID 83265107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).