6-(aminomethyl)pyridine-2,3-diamine

C6H10N4 — CID 82502425

IUPAC6-(aminomethyl)pyridine-2,3-diamine
SMILESNCc1ccc(N)c(N)n1
InChIInChI=1S/C6H10N4/c7-3-4-1-2-5(8)6(9)10-4/h1-2H,3,7-8H2,(H2,9,10)
InChIKeyHGODUSFIVVVFAA-UHFFFAOYSA-N
MW138.17 g/mol
LogP-0.30
Rot. Bonds1

About 6-(aminomethyl)pyridine-2,3-diamine

6-(aminomethyl)pyridine-2,3-diamine (PubChem CID 82502425) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 6-(aminomethyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-(aminomethyl)pyridine-2,3-diamine
PubChem CID82502425
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name6-(aminomethyl)pyridine-2,3-diamine
SMILESNCc1ccc(N)c(N)n1
InChIInChI=1S/C6H10N4/c7-3-4-1-2-5(8)6(9)10-4/h1-2H,3,7-8H2,(H2,9,10)
InChIKeyHGODUSFIVVVFAA-UHFFFAOYSA-N
XLogP-0.30
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)pyridine-2,3-diamine?
The IUPAC name of 6-(aminomethyl)pyridine-2,3-diamine (CID 82502425) is 6-(aminomethyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-(aminomethyl)pyridine-2,3-diamine?
The canonical SMILES for 6-(aminomethyl)pyridine-2,3-diamine is NCc1ccc(N)c(N)n1.
What is the InChIKey of 6-(aminomethyl)pyridine-2,3-diamine?
The InChIKey is HGODUSFIVVVFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c7-3-4-1-2-5(8)6(9)10-4/h1-2H,3,7-8H2,(H2,9,10).
What are the key properties of 6-(aminomethyl)pyridine-2,3-diamine?
6-(aminomethyl)pyridine-2,3-diamine has a molecular weight of 138.17 g/mol, XLogP of -0.30, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)pyridine-2,3-diamine is sourced from PubChem (CID 82502425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).