6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine

C8H15N3 — CID 130256413

IUPAC6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine
SMILESCNC1=C(N)C(C)=CC(C)N1
InChIInChI=1S/C8H15N3/c1-5-4-6(2)11-8(10-3)7(5)9/h4,6,10-11H,9H2,1-3H3
InChIKeySTCWTBFWUSBOMG-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.27
Rot. Bonds1

About 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine

6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine (PubChem CID 130256413) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine.

Molecular Properties

Compound Name6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine
PubChem CID130256413
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine
SMILESCNC1=C(N)C(C)=CC(C)N1
InChIInChI=1S/C8H15N3/c1-5-4-6(2)11-8(10-3)7(5)9/h4,6,10-11H,9H2,1-3H3
InChIKeySTCWTBFWUSBOMG-UHFFFAOYSA-N
XLogP0.27
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine?
The IUPAC name of 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine (CID 130256413) is 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine.
What is the SMILES notation for 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine?
The canonical SMILES for 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine is CNC1=C(N)C(C)=CC(C)N1.
What is the InChIKey of 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine?
The InChIKey is STCWTBFWUSBOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-5-4-6(2)11-8(10-3)7(5)9/h4,6,10-11H,9H2,1-3H3.
What are the key properties of 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine?
6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine has a molecular weight of 153.23 g/mol, XLogP of 0.27, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,2,4-trimethyl-1,2-dihydropyridine-5,6-diamine is sourced from PubChem (CID 130256413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).