2-N-pyridin-3-ylpyridine-2,5-diamine

C10H10N4 — CID 4764177

IUPAC2-N-pyridin-3-ylpyridine-2,5-diamine
SMILESNc1ccc(Nc2cccnc2)nc1
InChIInChI=1S/C10H10N4/c11-8-3-4-10(13-6-8)14-9-2-1-5-12-7-9/h1-7H,11H2,(H,13,14)
InChIKeyMRPSCVYKOWILOQ-UHFFFAOYSA-N
MW186.22 g/mol
LogP1.80
Rot. Bonds2

About 2-N-pyridin-3-ylpyridine-2,5-diamine

2-N-pyridin-3-ylpyridine-2,5-diamine (PubChem CID 4764177) has the molecular formula C10H10N4 and a molecular weight of 186.22 g/mol. Its IUPAC name is 2-N-pyridin-3-ylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-pyridin-3-ylpyridine-2,5-diamine
PubChem CID4764177
Molecular FormulaC10H10N4
Molecular Weight186.22 g/mol
Exact Mass186.09
IUPAC Name2-N-pyridin-3-ylpyridine-2,5-diamine
SMILESNc1ccc(Nc2cccnc2)nc1
InChIInChI=1S/C10H10N4/c11-8-3-4-10(13-6-8)14-9-2-1-5-12-7-9/h1-7H,11H2,(H,13,14)
InChIKeyMRPSCVYKOWILOQ-UHFFFAOYSA-N
XLogP1.80
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.22
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_NH_no_alk_A(1)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-N-pyridin-3-ylpyridine-2,5-diamine?
The IUPAC name of 2-N-pyridin-3-ylpyridine-2,5-diamine (CID 4764177) is 2-N-pyridin-3-ylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-pyridin-3-ylpyridine-2,5-diamine?
The canonical SMILES for 2-N-pyridin-3-ylpyridine-2,5-diamine is Nc1ccc(Nc2cccnc2)nc1.
What is the InChIKey of 2-N-pyridin-3-ylpyridine-2,5-diamine?
The InChIKey is MRPSCVYKOWILOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4/c11-8-3-4-10(13-6-8)14-9-2-1-5-12-7-9/h1-7H,11H2,(H,13,14).
What are the key properties of 2-N-pyridin-3-ylpyridine-2,5-diamine?
2-N-pyridin-3-ylpyridine-2,5-diamine has a molecular weight of 186.22 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-pyridin-3-ylpyridine-2,5-diamine is sourced from PubChem (CID 4764177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).