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

C13H16N4 — CID 83266097

IUPAC5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine
SMILESCc1cnc(NC(C)c2ccccn2)cc1N
InChIInChI=1S/C13H16N4/c1-9-8-16-13(7-11(9)14)17-10(2)12-5-3-4-6-15-12/h3-8,10H,1-2H3,(H3,14,16,17)
InChIKeyIHKRGFPMOSJBLW-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.54
Rot. Bonds3

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

5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine (PubChem CID 83266097) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine.

Molecular Properties

Compound Name5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine
PubChem CID83266097
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine
SMILESCc1cnc(NC(C)c2ccccn2)cc1N
InChIInChI=1S/C13H16N4/c1-9-8-16-13(7-11(9)14)17-10(2)12-5-3-4-6-15-12/h3-8,10H,1-2H3,(H3,14,16,17)
InChIKeyIHKRGFPMOSJBLW-UHFFFAOYSA-N
XLogP2.54
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-N-(1-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80781349
4-methyl-1-N-(1-pyridin-2-ylethyl)benzene-1,2-diamine
CID 43524351
5-methyl-2-N-(1-thiophen-3-ylethyl)pyridine-2,4-diamine
CID 83265635
3,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43195401
4-N-(1-pyridin-2-ylethyl)pyrimidine-4,5-diamine
CID 79916401
6-hydrazinyl-N-(1-pyridin-2-ylethyl)pyrazin-2-amine
CID 80906571
2,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43196549
5-methyl-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 115922253
4-chloro-1-N-(1-pyridin-2-ylethyl)benzene-1,2-diamine
CID 43524369
6-N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717521
3-amino-4-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 43524264
3-bromo-2-N-(1-pyridin-2-ylethyl)pyridine-2,5-diamine
CID 79531784

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine?
The IUPAC name of 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine (CID 83266097) is 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine.
What is the SMILES notation for 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine?
The canonical SMILES for 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine is Cc1cnc(NC(C)c2ccccn2)cc1N.
What is the InChIKey of 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine?
The InChIKey is IHKRGFPMOSJBLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-9-8-16-13(7-11(9)14)17-10(2)12-5-3-4-6-15-12/h3-8,10H,1-2H3,(H3,14,16,17).
What are the key properties of 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine?
5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine has a molecular weight of 228.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine is sourced from PubChem (CID 83266097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).