N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide

C11H15N3O — CID 169465091

IUPACN-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1ccc(N)c(C)n1
InChIInChI=1S/C11H15N3O/c1-8-11(12)6-5-10(14-8)4-3-7-13-9(2)15/h3-6H,7,12H2,1-2H3,(H,13,15)
InChIKeyNMGLKPMTZQXLCC-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.12
Rot. Bonds3

About N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide

N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide (PubChem CID 169465091) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide
PubChem CID169465091
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC NameN-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1ccc(N)c(C)n1
InChIInChI=1S/C11H15N3O/c1-8-11(12)6-5-10(14-8)4-3-7-13-9(2)15/h3-6H,7,12H2,1-2H3,(H,13,15)
InChIKeyNMGLKPMTZQXLCC-UHFFFAOYSA-N
XLogP1.12
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(5-hydroxy-2-pyridinyl)prop-2-enyl]acetamide
CID 169464931
N-[3-(5-fluoro-2-pyridinyl)prop-2-enyl]acetamide
CID 169464899
N-[3-(5-chloro-2-pyridinyl)prop-2-enyl]acetamide
CID 169464897
N-[3-(2-amino-3-methylphenyl)prop-2-enyl]acetamide
CID 169465158
methyl 6-(3-acetamidoprop-1-enyl)pyridine-2-carboxylate
CID 169465889
N-[3-(2-amino-4,6-dichloropyrimidin-5-yl)prop-2-enyl]acetamide
CID 169466857
N-[3-[4-amino-3-(trifluoromethyl)phenyl]prop-2-enyl]acetamide
CID 169466074
N-[3-(2-amino-4-chloropyrimidin-5-yl)prop-2-enyl]acetamide
CID 169465228
N-[3-[2-amino-5-(trifluoromethyl)phenyl]prop-2-enyl]acetamide
CID 169466076
N-[3-(2-amino-4-bromophenyl)prop-2-enyl]acetamide
CID 169466523
N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide
CID 169464873
N-[3-(3,4-dimethylphenyl)prop-2-enyl]acetamide
CID 169464973

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide?
The IUPAC name of N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide (CID 169465091) is N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide.
What is the SMILES notation for N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide?
The canonical SMILES for N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide is CC(=O)NCC=Cc1ccc(N)c(C)n1.
What is the InChIKey of N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide?
The InChIKey is NMGLKPMTZQXLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-11(12)6-5-10(14-8)4-3-7-13-9(2)15/h3-6H,7,12H2,1-2H3,(H,13,15).
What are the key properties of N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide?
N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide has a molecular weight of 205.26 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-amino-6-methyl-2-pyridinyl)prop-2-enyl]acetamide is sourced from PubChem (CID 169465091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).