5-methyl-2-N-propan-2-ylpyridine-2,3-diamine

C9H15N3 — CID 64984981

IUPAC5-methyl-2-N-propan-2-ylpyridine-2,3-diamine
SMILESCc1cnc(NC(C)C)c(N)c1
InChIInChI=1S/C9H15N3/c1-6(2)12-9-8(10)4-7(3)5-11-9/h4-6H,10H2,1-3H3,(H,11,12)
InChIKeyIZKCUPYMFVIDEN-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.79
Rot. Bonds2

About 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine

5-methyl-2-N-propan-2-ylpyridine-2,3-diamine (PubChem CID 64984981) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine.

Molecular Properties

Compound Name5-methyl-2-N-propan-2-ylpyridine-2,3-diamine
PubChem CID64984981
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name5-methyl-2-N-propan-2-ylpyridine-2,3-diamine
SMILESCc1cnc(NC(C)C)c(N)c1
InChIInChI=1S/C9H15N3/c1-6(2)12-9-8(10)4-7(3)5-11-9/h4-6H,10H2,1-3H3,(H,11,12)
InChIKeyIZKCUPYMFVIDEN-UHFFFAOYSA-N
XLogP1.79
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine?
The IUPAC name of 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine (CID 64984981) is 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine.
What is the SMILES notation for 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine?
The canonical SMILES for 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine is Cc1cnc(NC(C)C)c(N)c1.
What is the InChIKey of 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine?
The InChIKey is IZKCUPYMFVIDEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-6(2)12-9-8(10)4-7(3)5-11-9/h4-6H,10H2,1-3H3,(H,11,12).
What are the key properties of 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine?
5-methyl-2-N-propan-2-ylpyridine-2,3-diamine has a molecular weight of 165.24 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-N-propan-2-ylpyridine-2,3-diamine is sourced from PubChem (CID 64984981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).