4-propan-2-yl-1,6-dihydropyridazin-6-amine

C7H13N3 — CID 144665614

IUPAC4-propan-2-yl-1,6-dihydropyridazin-6-amine
SMILESCC(C)C1=CC(N)NN=C1
InChIInChI=1S/C7H13N3/c1-5(2)6-3-7(8)10-9-4-6/h3-5,7,10H,8H2,1-2H3
InChIKeyJHXAHTKVBVFKKF-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.44
Rot. Bonds1

About 4-propan-2-yl-1,6-dihydropyridazin-6-amine

4-propan-2-yl-1,6-dihydropyridazin-6-amine (PubChem CID 144665614) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-propan-2-yl-1,6-dihydropyridazin-6-amine.

Molecular Properties

Compound Name4-propan-2-yl-1,6-dihydropyridazin-6-amine
PubChem CID144665614
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name4-propan-2-yl-1,6-dihydropyridazin-6-amine
SMILESCC(C)C1=CC(N)NN=C1
InChIInChI=1S/C7H13N3/c1-5(2)6-3-7(8)10-9-4-6/h3-5,7,10H,8H2,1-2H3
InChIKeyJHXAHTKVBVFKKF-UHFFFAOYSA-N
XLogP0.44
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-1,6-dihydropyridazin-6-amine?
The IUPAC name of 4-propan-2-yl-1,6-dihydropyridazin-6-amine (CID 144665614) is 4-propan-2-yl-1,6-dihydropyridazin-6-amine.
What is the SMILES notation for 4-propan-2-yl-1,6-dihydropyridazin-6-amine?
The canonical SMILES for 4-propan-2-yl-1,6-dihydropyridazin-6-amine is CC(C)C1=CC(N)NN=C1.
What is the InChIKey of 4-propan-2-yl-1,6-dihydropyridazin-6-amine?
The InChIKey is JHXAHTKVBVFKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-5(2)6-3-7(8)10-9-4-6/h3-5,7,10H,8H2,1-2H3.
What are the key properties of 4-propan-2-yl-1,6-dihydropyridazin-6-amine?
4-propan-2-yl-1,6-dihydropyridazin-6-amine has a molecular weight of 139.20 g/mol, XLogP of 0.44, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1,6-dihydropyridazin-6-amine is sourced from PubChem (CID 144665614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).