(3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol

C14H20N4O — CID 105098012

IUPAC(3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1cc(C)nnc1CC
InChIInChI=1S/C14H20N4O/c1-4-8-18-13(6-7-15-18)14(19)11-9-10(3)16-17-12(11)5-2/h6-7,9,14,19H,4-5,8H2,1-3H3
InChIKeyIBAGWLXIWCHXLT-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.04
Rot. Bonds5

About (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol

(3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol (PubChem CID 105098012) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol
PubChem CID105098012
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name(3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1cc(C)nnc1CC
InChIInChI=1S/C14H20N4O/c1-4-8-18-13(6-7-15-18)14(19)11-9-10(3)16-17-12(11)5-2/h6-7,9,14,19H,4-5,8H2,1-3H3
InChIKeyIBAGWLXIWCHXLT-UHFFFAOYSA-N
XLogP2.04
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2,5-dimethylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 63977386
(3-ethyl-6-methylpyridazin-4-yl)-(furan-3-yl)methanol
CID 105097197
(2-aminophenyl)-(2-propylpyrazol-3-yl)methanol
CID 64831998
(4-chloro-2-fluorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 63975297
(4-ethylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 63976106
(2-bromofuran-3-yl)-(2-propylpyrazol-3-yl)methanol
CID 106859237
(4-chloro-1-ethylpyrazol-5-yl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
CID 105127736
(2-bromo-5-chlorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 66156283
(3,4-dichlorophenyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
CID 105133302
(2,3-difluorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 63975691
2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol
CID 114743786
(2-propylpyrazol-3-yl)-pyrimidin-5-ylmethanol
CID 114556923

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol (CID 105098012) is (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)c1cc(C)nnc1CC.
What is the InChIKey of (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol?
The InChIKey is IBAGWLXIWCHXLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-4-8-18-13(6-7-15-18)14(19)11-9-10(3)16-17-12(11)5-2/h6-7,9,14,19H,4-5,8H2,1-3H3.
What are the key properties of (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol?
(3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol has a molecular weight of 260.34 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-6-methylpyridazin-4-yl)-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 105098012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).