N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide

C16H19N3O2 — CID 163437917

IUPACN-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide
SMILESCCCCc1ccc(NC(=O)Cc2cccc(O)c2)nn1
InChIInChI=1S/C16H19N3O2/c1-2-3-6-13-8-9-15(19-18-13)17-16(21)11-12-5-4-7-14(20)10-12/h4-5,7-10,20H,2-3,6,11H2,1H3,(H,17,19,21)
InChIKeyAWBRKDJGMLFIDK-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.71
Rot. Bonds6

About N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide

N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide (PubChem CID 163437917) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide
PubChem CID163437917
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide
SMILESCCCCc1ccc(NC(=O)Cc2cccc(O)c2)nn1
InChIInChI=1S/C16H19N3O2/c1-2-3-6-13-8-9-15(19-18-13)17-16(21)11-12-5-4-7-14(20)10-12/h4-5,7-10,20H,2-3,6,11H2,1H3,(H,17,19,21)
InChIKeyAWBRKDJGMLFIDK-UHFFFAOYSA-N
XLogP2.71
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[4-[5-[[2-[3-[2-oxo-2-(propylamino)ethyl]phenyl]acetyl]amino]-1,3,4-thiadiazol-2-yl]butyl]pyridazin-3-yl]-2-phenylacetamide
CID 74982714
N-(6-ethylpyridazin-3-yl)-2-phenylacetamide
CID 123748541
N-[6-[4-[5-[[2-[3-(1-hydroxyethyl)phenyl]acetyl]amino]-1,3,4-thiadiazol-2-yl]butyl]pyridazin-3-yl]-2-phenylacetamide
CID 74982793
N-[6-[4-[5-[[2-[3-(2-methylsulfonylethyl)phenyl]acetyl]amino]-1,3,4-thiadiazol-2-yl]butyl]pyridazin-3-yl]-2-phenylacetamide
CID 147577272
2-phenyl-N-[6-[4-[5-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]-1,3,4-thiadiazol-2-yl]butyl]pyridazin-3-yl]acetamide
CID 74982757
2-(3-hydroxyphenyl)-N-(5-iodo-2-pyridinyl)acetamide
CID 65099226
N-(6-ethoxy-2-pyridinyl)-2-(3-hydroxyphenyl)acetamide
CID 71865850
3-octacosylphenol
CID 101292719
3-hentriacontylphenol
CID 101292722
2-(3-ethylphenyl)-N-[5-[4-(6-methylpyridazin-3-yl)butyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 134402941
2-(3-bromophenyl)-N-[6-[4-[4-[hydroxy(methylamino)methyl]triazol-1-yl]butyl]pyridazin-3-yl]acetamide
CID 138574684
N-tert-butyl-2-(3-hydroxyphenyl)acetamide
CID 61399885

Frequently Asked Questions

What is the IUPAC name of N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide (CID 163437917) is N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide is CCCCc1ccc(NC(=O)Cc2cccc(O)c2)nn1.
What is the InChIKey of N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide?
The InChIKey is AWBRKDJGMLFIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-2-3-6-13-8-9-15(19-18-13)17-16(21)11-12-5-4-7-14(20)10-12/h4-5,7-10,20H,2-3,6,11H2,1H3,(H,17,19,21).
What are the key properties of N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide?
N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-butylpyridazin-3-yl)-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 163437917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).