4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine

C12H23N3 — CID 143438303

IUPAC4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine
SMILESCC1C=CC(C2CCC(N)CC2)N(C)N1
InChIInChI=1S/C12H23N3/c1-9-3-8-12(15(2)14-9)10-4-6-11(13)7-5-10/h3,8-12,14H,4-7,13H2,1-2H3
InChIKeyVBYIIDQGUAWGPU-UHFFFAOYSA-N
MW209.34 g/mol
LogP1.27
Rot. Bonds1

About 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine

4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine (PubChem CID 143438303) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine
PubChem CID143438303
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine
SMILESCC1C=CC(C2CCC(N)CC2)N(C)N1
InChIInChI=1S/C12H23N3/c1-9-3-8-12(15(2)14-9)10-4-6-11(13)7-5-10/h3,8-12,14H,4-7,13H2,1-2H3
InChIKeyVBYIIDQGUAWGPU-UHFFFAOYSA-N
XLogP1.27
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Cycloheptyl-1-(1,6-dimethylcyclohex-2-en-1-yl)-1-methylhydrazine
CID 70516475
(2S)-1-cyclohexyl-N,6-dimethylhept-3-en-2-amine
CID 91020332
(2R)-1-cyclohexyl-N,6-dimethylhept-3-en-2-amine
CID 91120114
1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine
CID 134266582
1-ethyl-2-methyl-1-[(Z)-3-methyloct-6-en-2-yl]hydrazine
CID 135199778
N-[3-(1-aminoethyl)cyclohexyl]cyclohex-2-en-1-amine
CID 137402789
(Z,2S)-1-cyclohexyl-N,6-dimethylhept-3-en-2-amine
CID 140424314
(Z,2R)-1-cyclohexyl-N,6-dimethylhept-3-en-2-amine
CID 140424417
(Z)-4-[amino(cyclohexylmethyl)amino]-N-(cyclohexylmethyl)hex-2-en-1-amine;methanamine
CID 143467520
N-methyl-4-[(E)-pent-3-enyl]cyclohexan-1-amine
CID 145234997
[4-[(2,2-Dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine
CID 146175353
1-[(2Z)-7,7-dimethylcyclonon-2-en-1-yl]-1,2-dimethylhydrazine
CID 146259463

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine?
The IUPAC name of 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine (CID 143438303) is 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine.
What is the SMILES notation for 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine?
The canonical SMILES for 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine is CC1C=CC(C2CCC(N)CC2)N(C)N1.
What is the InChIKey of 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine?
The InChIKey is VBYIIDQGUAWGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-9-3-8-12(15(2)14-9)10-4-6-11(13)7-5-10/h3,8-12,14H,4-7,13H2,1-2H3.
What are the key properties of 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine?
4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine has a molecular weight of 209.34 g/mol, XLogP of 1.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethyl-3,6-dihydro-1H-pyridazin-3-yl)cyclohexan-1-amine is sourced from PubChem (CID 143438303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).