3-methyl-4-propan-2-yl-3,4-dihydropyridazine

C8H14N2 — CID 129093179

IUPAC3-methyl-4-propan-2-yl-3,4-dihydropyridazine
SMILESCC(C)C1C=CN=NC1C
InChIInChI=1S/C8H14N2/c1-6(2)8-4-5-9-10-7(8)3/h4-8H,1-3H3
InChIKeyAAKVTXXKDBHBRS-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.63
Rot. Bonds1

About 3-methyl-4-propan-2-yl-3,4-dihydropyridazine

3-methyl-4-propan-2-yl-3,4-dihydropyridazine (PubChem CID 129093179) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 3-methyl-4-propan-2-yl-3,4-dihydropyridazine.

Molecular Properties

Compound Name3-methyl-4-propan-2-yl-3,4-dihydropyridazine
PubChem CID129093179
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name3-methyl-4-propan-2-yl-3,4-dihydropyridazine
SMILESCC(C)C1C=CN=NC1C
InChIInChI=1S/C8H14N2/c1-6(2)8-4-5-9-10-7(8)3/h4-8H,1-3H3
InChIKeyAAKVTXXKDBHBRS-UHFFFAOYSA-N
XLogP2.63
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-propan-2-yl-2,3-dihydropyridine
CID 134320651
5,6-dimethyl-7-propan-2-ylcyclohepta-1,3-diene
CID 123733561
3-methyl-4-propan-2-ylcyclohepta-1,5-dien-1-amine
CID 170370508
(3S,4S)-4-methyl-3-propan-2-ylcyclohexene
CID 54375477
(1R,2R)-2-propan-2-ylcyclopent-3-en-1-ol
CID 58878675
2,6-di(propan-2-yl)cyclohexa-2,4-dien-1-ol
CID 123183468
5-methyl-6-propan-2-yloxycyclohexa-1,3-diene
CID 121263648
5-methyliodanuidyl-6-propan-2-ylcyclohexa-1,3-diene
CID 163742119
2,3-di(propan-2-yl)-2,3-dihydronaphthalene
CID 22950269
1,6-difluoro-2-methyl-5-propan-2-ylcyclohexa-1,3-diene
CID 90950295
N'-propan-2-yl-N-(4-propan-2-ylcyclobut-2-en-1-yl)methanediamine
CID 174307818
4-hydroxy-2-propan-2-yl-4H-pyridin-3-one
CID 118460220

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-propan-2-yl-3,4-dihydropyridazine?
The IUPAC name of 3-methyl-4-propan-2-yl-3,4-dihydropyridazine (CID 129093179) is 3-methyl-4-propan-2-yl-3,4-dihydropyridazine.
What is the SMILES notation for 3-methyl-4-propan-2-yl-3,4-dihydropyridazine?
The canonical SMILES for 3-methyl-4-propan-2-yl-3,4-dihydropyridazine is CC(C)C1C=CN=NC1C.
What is the InChIKey of 3-methyl-4-propan-2-yl-3,4-dihydropyridazine?
The InChIKey is AAKVTXXKDBHBRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-6(2)8-4-5-9-10-7(8)3/h4-8H,1-3H3.
What are the key properties of 3-methyl-4-propan-2-yl-3,4-dihydropyridazine?
3-methyl-4-propan-2-yl-3,4-dihydropyridazine has a molecular weight of 138.21 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-propan-2-yl-3,4-dihydropyridazine is sourced from PubChem (CID 129093179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).