2-ethyl-1H-pyridine-2,5-diamine

C7H13N3 — CID 68833078

IUPAC2-ethyl-1H-pyridine-2,5-diamine
SMILESCCC1(N)C=CC(N)=CN1
InChIInChI=1S/C7H13N3/c1-2-7(9)4-3-6(8)5-10-7/h3-5,10H,2,8-9H2,1H3
InChIKeyYTUTZRKPFRPZNF-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.01
Rot. Bonds1

About 2-ethyl-1H-pyridine-2,5-diamine

2-ethyl-1H-pyridine-2,5-diamine (PubChem CID 68833078) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 2-ethyl-1H-pyridine-2,5-diamine.

Molecular Properties

Compound Name2-ethyl-1H-pyridine-2,5-diamine
PubChem CID68833078
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name2-ethyl-1H-pyridine-2,5-diamine
SMILESCCC1(N)C=CC(N)=CN1
InChIInChI=1S/C7H13N3/c1-2-7(9)4-3-6(8)5-10-7/h3-5,10H,2,8-9H2,1H3
InChIKeyYTUTZRKPFRPZNF-UHFFFAOYSA-N
XLogP0.01
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1H-pyridine-2,5-diamine?
The IUPAC name of 2-ethyl-1H-pyridine-2,5-diamine (CID 68833078) is 2-ethyl-1H-pyridine-2,5-diamine.
What is the SMILES notation for 2-ethyl-1H-pyridine-2,5-diamine?
The canonical SMILES for 2-ethyl-1H-pyridine-2,5-diamine is CCC1(N)C=CC(N)=CN1.
What is the InChIKey of 2-ethyl-1H-pyridine-2,5-diamine?
The InChIKey is YTUTZRKPFRPZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-2-7(9)4-3-6(8)5-10-7/h3-5,10H,2,8-9H2,1H3.
What are the key properties of 2-ethyl-1H-pyridine-2,5-diamine?
2-ethyl-1H-pyridine-2,5-diamine has a molecular weight of 139.20 g/mol, XLogP of 0.01, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1H-pyridine-2,5-diamine is sourced from PubChem (CID 68833078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).