3,4,5-trimethyl-6-propan-2-ylpyridazine

C10H16N2 — CID 59339142

IUPAC3,4,5-trimethyl-6-propan-2-ylpyridazine
SMILESCc1nnc(C(C)C)c(C)c1C
InChIInChI=1S/C10H16N2/c1-6(2)10-8(4)7(3)9(5)11-12-10/h6H,1-5H3
InChIKeyYIAVXWRWABZBQH-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.53
Rot. Bonds1

About 3,4,5-trimethyl-6-propan-2-ylpyridazine

3,4,5-trimethyl-6-propan-2-ylpyridazine (PubChem CID 59339142) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 3,4,5-trimethyl-6-propan-2-ylpyridazine.

Molecular Properties

Compound Name3,4,5-trimethyl-6-propan-2-ylpyridazine
PubChem CID59339142
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name3,4,5-trimethyl-6-propan-2-ylpyridazine
SMILESCc1nnc(C(C)C)c(C)c1C
InChIInChI=1S/C10H16N2/c1-6(2)10-8(4)7(3)9(5)11-12-10/h6H,1-5H3
InChIKeyYIAVXWRWABZBQH-UHFFFAOYSA-N
XLogP2.53
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Pyridazine, 3,4,6-trimethyl-
CID 12440100
Tetramethylpyridazine
CID 12750033
4,5-Diazaindan, 6,7-dimethyl-
CID 58890735
Pyridazine, 4-ethyl-3,6-dimethyl-
CID 143818473
1,4-Dimethyl-5,6,7,8,9,10-hexahydrocycloocta[d]pyridazine
CID 90182986
1,2-Diazabenzocycloheptane, 3-methyl-
CID 101878952
Cinnoline, 5,6,7,8-tetrahydro-3,4-dimethyl-
CID 165339766
3,4-Pentamethylene-5,6,7,8-tetrahydrocinnoline
CID 165339889
4-Methyl-5,6,7,8,9,10-hexahydrocycloocta[d]pyridazine
CID 139297356
4-(2-Fluoropropan-2-yl)-3,6-dimethylpyridazine
CID 117865260
6-Tert-butyl-4-(2-fluoropropan-2-yl)-3-prop-1-ynylpyridazine
CID 121391281
6-Tert-butyl-4-(2-fluoropropan-2-yl)-3-methylpyridazine
CID 121391283

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethyl-6-propan-2-ylpyridazine?
The IUPAC name of 3,4,5-trimethyl-6-propan-2-ylpyridazine (CID 59339142) is 3,4,5-trimethyl-6-propan-2-ylpyridazine.
What is the SMILES notation for 3,4,5-trimethyl-6-propan-2-ylpyridazine?
The canonical SMILES for 3,4,5-trimethyl-6-propan-2-ylpyridazine is Cc1nnc(C(C)C)c(C)c1C.
What is the InChIKey of 3,4,5-trimethyl-6-propan-2-ylpyridazine?
The InChIKey is YIAVXWRWABZBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-6(2)10-8(4)7(3)9(5)11-12-10/h6H,1-5H3.
What are the key properties of 3,4,5-trimethyl-6-propan-2-ylpyridazine?
3,4,5-trimethyl-6-propan-2-ylpyridazine has a molecular weight of 164.25 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethyl-6-propan-2-ylpyridazine is sourced from PubChem (CID 59339142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).