6-propan-2-ylpyridine-3,4-diamine

C8H13N3 — CID 22380346

IUPAC6-propan-2-ylpyridine-3,4-diamine
SMILESCC(C)c1cc(N)c(N)cn1
InChIInChI=1S/C8H13N3/c1-5(2)8-3-6(9)7(10)4-11-8/h3-5H,10H2,1-2H3,(H2,9,11)
InChIKeySSIZLGCEEJDZHY-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.37
Rot. Bonds1

About 6-propan-2-ylpyridine-3,4-diamine

6-propan-2-ylpyridine-3,4-diamine (PubChem CID 22380346) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 6-propan-2-ylpyridine-3,4-diamine.

Molecular Properties

Compound Name6-propan-2-ylpyridine-3,4-diamine
PubChem CID22380346
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name6-propan-2-ylpyridine-3,4-diamine
SMILESCC(C)c1cc(N)c(N)cn1
InChIInChI=1S/C8H13N3/c1-5(2)8-3-6(9)7(10)4-11-8/h3-5H,10H2,1-2H3,(H2,9,11)
InChIKeySSIZLGCEEJDZHY-UHFFFAOYSA-N
XLogP1.37
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylpyridine-3,4-diamine?
The IUPAC name of 6-propan-2-ylpyridine-3,4-diamine (CID 22380346) is 6-propan-2-ylpyridine-3,4-diamine.
What is the SMILES notation for 6-propan-2-ylpyridine-3,4-diamine?
The canonical SMILES for 6-propan-2-ylpyridine-3,4-diamine is CC(C)c1cc(N)c(N)cn1.
What is the InChIKey of 6-propan-2-ylpyridine-3,4-diamine?
The InChIKey is SSIZLGCEEJDZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-5(2)8-3-6(9)7(10)4-11-8/h3-5H,10H2,1-2H3,(H2,9,11).
What are the key properties of 6-propan-2-ylpyridine-3,4-diamine?
6-propan-2-ylpyridine-3,4-diamine has a molecular weight of 151.21 g/mol, XLogP of 1.37, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylpyridine-3,4-diamine is sourced from PubChem (CID 22380346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).