5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine

C11H19N3 — CID 90289170

IUPAC5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine
SMILESNC1=CC(CC2CCCCC2)=CNN1
InChIInChI=1S/C11H19N3/c12-11-7-10(8-13-14-11)6-9-4-2-1-3-5-9/h7-9,13-14H,1-6,12H2
InChIKeyNSWCIIHLYUWWCK-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.75
Rot. Bonds2

About 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine

5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine (PubChem CID 90289170) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine.

Molecular Properties

Compound Name5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine
PubChem CID90289170
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine
SMILESNC1=CC(CC2CCCCC2)=CNN1
InChIInChI=1S/C11H19N3/c12-11-7-10(8-13-14-11)6-9-4-2-1-3-5-9/h7-9,13-14H,1-6,12H2
InChIKeyNSWCIIHLYUWWCK-UHFFFAOYSA-N
XLogP1.75
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine?
The IUPAC name of 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine (CID 90289170) is 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine.
What is the SMILES notation for 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine?
The canonical SMILES for 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine is NC1=CC(CC2CCCCC2)=CNN1.
What is the InChIKey of 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine?
The InChIKey is NSWCIIHLYUWWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c12-11-7-10(8-13-14-11)6-9-4-2-1-3-5-9/h7-9,13-14H,1-6,12H2.
What are the key properties of 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine?
5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine has a molecular weight of 193.29 g/mol, XLogP of 1.75, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylmethyl)-1,2-dihydropyridazin-3-amine is sourced from PubChem (CID 90289170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).