4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine

C10H13BrN2 — CID 153298582

IUPAC4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine
SMILESCC(C)c1nncc(C2CC2)c1Br
InChIInChI=1S/C10H13BrN2/c1-6(2)10-9(11)8(5-12-13-10)7-3-4-7/h5-7H,3-4H2,1-2H3
InChIKeyBCYVPOSIVGIEDS-UHFFFAOYSA-N
MW241.13 g/mol
LogP3.24
Rot. Bonds2

About 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine

4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine (PubChem CID 153298582) has the molecular formula C10H13BrN2 and a molecular weight of 241.13 g/mol. Its IUPAC name is 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine.

Molecular Properties

Compound Name4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine
PubChem CID153298582
Molecular FormulaC10H13BrN2
Molecular Weight241.13 g/mol
Exact Mass240.03
IUPAC Name4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine
SMILESCC(C)c1nncc(C2CC2)c1Br
InChIInChI=1S/C10H13BrN2/c1-6(2)10-9(11)8(5-12-13-10)7-3-4-7/h5-7H,3-4H2,1-2H3
InChIKeyBCYVPOSIVGIEDS-UHFFFAOYSA-N
XLogP3.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-1-cyclopropyl-5-fluoro-3-propan-2-ylbenzene
CID 137459327
4-cyclopropyl-2-propan-2-ylpyridin-3-amine
CID 134168281
4-propan-2-yl-2,3-dihydro-1H-imidazo[4,5-d]pyridazin-2-ol
CID 130250972
4-cyclobutyl-6-methyl-3-propan-2-ylpyridazine;ethane
CID 165403998
5-bromo-6-propan-2-yl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
CID 66298717
4-cyclopropyl-5-propan-2-yl-1H-pyrazole
CID 130325431
6-bromo-3-cyclopropylpyridine-2-carboxamide
CID 146404751
3-cyclopropyl-2-methyl-5-propan-2-ylpyridine
CID 142320143
5-bromo-2-cyclohexyl-6-propan-2-ylpyrimidin-4-amine
CID 66300489
3-chloro-5-cyclopropylpyridazine
CID 118611458
4-cyclopropyl-1,5-di(propan-2-yl)pyrazole
CID 168800092
4-cyclopropyl-5-methyl-2-propan-2-ylpyridine
CID 165379120

Frequently Asked Questions

What is the IUPAC name of 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine?
The IUPAC name of 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine (CID 153298582) is 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine.
What is the SMILES notation for 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine?
The canonical SMILES for 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine is CC(C)c1nncc(C2CC2)c1Br.
What is the InChIKey of 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine?
The InChIKey is BCYVPOSIVGIEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2/c1-6(2)10-9(11)8(5-12-13-10)7-3-4-7/h5-7H,3-4H2,1-2H3.
What are the key properties of 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine?
4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine has a molecular weight of 241.13 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-5-cyclopropyl-3-propan-2-ylpyridazine is sourced from PubChem (CID 153298582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).