6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine

C7H13N3 — CID 86341165

IUPAC6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine
SMILESCNC1=C(N)C=CC(C)N1
InChIInChI=1S/C7H13N3/c1-5-3-4-6(8)7(9-2)10-5/h3-5,9-10H,8H2,1-2H3
InChIKeyQZPXRNDVCNDUBH-UHFFFAOYSA-N
MW139.20 g/mol
LogP-0.12
Rot. Bonds1

About 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine

6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine (PubChem CID 86341165) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine.

Molecular Properties

Compound Name6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine
PubChem CID86341165
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine
SMILESCNC1=C(N)C=CC(C)N1
InChIInChI=1S/C7H13N3/c1-5-3-4-6(8)7(9-2)10-5/h3-5,9-10H,8H2,1-2H3
InChIKeyQZPXRNDVCNDUBH-UHFFFAOYSA-N
XLogP-0.12
TPSA50.08 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 ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine?
The IUPAC name of 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine (CID 86341165) is 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine.
What is the SMILES notation for 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine?
The canonical SMILES for 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine is CNC1=C(N)C=CC(C)N1.
What is the InChIKey of 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine?
The InChIKey is QZPXRNDVCNDUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-5-3-4-6(8)7(9-2)10-5/h3-5,9-10H,8H2,1-2H3.
What are the key properties of 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine?
6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine has a molecular weight of 139.20 g/mol, XLogP of -0.12, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,2-dimethyl-1,2-dihydropyridine-5,6-diamine is sourced from PubChem (CID 86341165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).