N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide

C10H12N2O — CID 130015227

IUPACN-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide
SMILESC=C(NC(C)=O)c1cccc(C)n1
InChIInChI=1S/C10H12N2O/c1-7-5-4-6-10(11-7)8(2)12-9(3)13/h4-6H,2H2,1,3H3,(H,12,13)
InChIKeyCOSUFWWICPLEPL-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.50
Rot. Bonds2

About N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide

N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide (PubChem CID 130015227) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide.

Molecular Properties

Compound NameN-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide
PubChem CID130015227
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC NameN-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide
SMILESC=C(NC(C)=O)c1cccc(C)n1
InChIInChI=1S/C10H12N2O/c1-7-5-4-6-10(11-7)8(2)12-9(3)13/h4-6H,2H2,1,3H3,(H,12,13)
InChIKeyCOSUFWWICPLEPL-UHFFFAOYSA-N
XLogP1.50
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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6-Ethyl-2-picoline
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6-Methyl-2-pyridinecarbothioamide
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N-(propan-2-yl)-N'-(pyridin-2-ylmethyl)ethanediamide
CID 2053858
N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]acetamide
CID 459083
2-Acetamido-6-methylpyridine
CID 220486
2,6-Dimethyl-3-pyridylamine
CID 76964
Methyl(6-methyl-2-pyridylmethyl)amine
CID 81438
(6-Methylpyridin-2-yl)methanamine
CID 246721
N-(pyridin-2-ylmethyl)acetamide
CID 5084090
US10800755, Example 31
CID 142429285

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide?
The IUPAC name of N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide (CID 130015227) is N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide.
What is the SMILES notation for N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide?
The canonical SMILES for N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide is C=C(NC(C)=O)c1cccc(C)n1.
What is the InChIKey of N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide?
The InChIKey is COSUFWWICPLEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-7-5-4-6-10(11-7)8(2)12-9(3)13/h4-6H,2H2,1,3H3,(H,12,13).
What are the key properties of N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide?
N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide has a molecular weight of 176.22 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methyl-2-pyridinyl)ethenyl]acetamide is sourced from PubChem (CID 130015227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).