1,6-dihydropyridazin-3-ylmethanamine

C5H9N3 — CID 118066573

IUPAC1,6-dihydropyridazin-3-ylmethanamine
SMILESNCC1=NNCC=C1
InChIInChI=1S/C5H9N3/c6-4-5-2-1-3-7-8-5/h1-2,7H,3-4,6H2
InChIKeyBNOKXDPRBSIWAM-UHFFFAOYSA-N
MW111.15 g/mol
LogP-0.54
Rot. Bonds1

About 1,6-dihydropyridazin-3-ylmethanamine

1,6-dihydropyridazin-3-ylmethanamine (PubChem CID 118066573) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 1,6-dihydropyridazin-3-ylmethanamine.

Molecular Properties

Compound Name1,6-dihydropyridazin-3-ylmethanamine
PubChem CID118066573
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name1,6-dihydropyridazin-3-ylmethanamine
SMILESNCC1=NNCC=C1
InChIInChI=1S/C5H9N3/c6-4-5-2-1-3-7-8-5/h1-2,7H,3-4,6H2
InChIKeyBNOKXDPRBSIWAM-UHFFFAOYSA-N
XLogP-0.54
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Trifluoromethyl)-1,6-dihydropyridazine
CID 20580534
3-(2-Fluoroethyl)-1,6-dihydropyridazine
CID 122683484
6-Methyl-1,6-dihydropyridazine
CID 19962896
3-Methyl-1,6-dihydropyridazine
CID 22915395
3,5-Dimethyl-1,6-dihydropyridazine
CID 29927534
6-Chloro-3-methyl-1,6-dihydropyridazine
CID 53434684
N-[(Z)-but-3-en-2-ylideneamino]prop-2-en-1-amine
CID 90248299
3-(Chloromethyl)-1,6-dihydropyridazine
CID 117692143
3,6-Dimethyl-1,6-dihydropyridazine
CID 123413461
3-Propan-2-yl-1,6-dihydropyridazine
CID 126689854
N-[(E)-[(Z)-pent-3-en-2-ylidene]amino]methanamine
CID 134467191
N-[(Z)-[(Z)-pent-3-en-2-ylidene]amino]methanamine
CID 137472060

Frequently Asked Questions

What is the IUPAC name of 1,6-dihydropyridazin-3-ylmethanamine?
The IUPAC name of 1,6-dihydropyridazin-3-ylmethanamine (CID 118066573) is 1,6-dihydropyridazin-3-ylmethanamine.
What is the SMILES notation for 1,6-dihydropyridazin-3-ylmethanamine?
The canonical SMILES for 1,6-dihydropyridazin-3-ylmethanamine is NCC1=NNCC=C1.
What is the InChIKey of 1,6-dihydropyridazin-3-ylmethanamine?
The InChIKey is BNOKXDPRBSIWAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c6-4-5-2-1-3-7-8-5/h1-2,7H,3-4,6H2.
What are the key properties of 1,6-dihydropyridazin-3-ylmethanamine?
1,6-dihydropyridazin-3-ylmethanamine has a molecular weight of 111.15 g/mol, XLogP of -0.54, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dihydropyridazin-3-ylmethanamine is sourced from PubChem (CID 118066573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).