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

C10H13N3O — CID 169464873

IUPACN-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1cccnc1N
InChIInChI=1S/C10H13N3O/c1-8(14)12-6-2-4-9-5-3-7-13-10(9)11/h2-5,7H,6H2,1H3,(H2,11,13)(H,12,14)
InChIKeyBUDPVLMZTXAWAZ-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.81
Rot. Bonds3

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

N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide (PubChem CID 169464873) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide
PubChem CID169464873
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC NameN-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1cccnc1N
InChIInChI=1S/C10H13N3O/c1-8(14)12-6-2-4-9-5-3-7-13-10(9)11/h2-5,7H,6H2,1H3,(H2,11,13)(H,12,14)
InChIKeyBUDPVLMZTXAWAZ-UHFFFAOYSA-N
XLogP0.81
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-quinolin-5-ylprop-2-enyl)acetamide
CID 169465651
N-[3-(3-hydroxy-2-pyridinyl)prop-2-enyl]acetamide
CID 169464929
N-[3-(2-amino-3-methylphenyl)prop-2-enyl]acetamide
CID 169465158
N-[3-(2-amino-5-chloro-3-pyridinyl)prop-2-enyl]acetamide
CID 169465064
N-[3-(2-amino-4-chloropyrimidin-5-yl)prop-2-enyl]acetamide
CID 169465228
N-[3-(3-cyano-2-pyridinyl)prop-2-enyl]acetamide
CID 169465094
N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide
CID 169464992
N-(3-naphthalen-1-ylprop-2-enyl)acetamide
CID 169465612
N-[3-(3-amino-6-chloropyridazin-4-yl)prop-2-enyl]acetamide
CID 169465223
3-(3-acetamidoprop-1-enyl)-2-methylbenzoic acid
CID 169465735
N-[3-(2-ethoxyphenyl)prop-2-enyl]acetamide
CID 169465357
N-[3-(2-amino-1,3-benzothiazol-4-yl)prop-2-enyl]acetamide
CID 169465623

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide?
The IUPAC name of N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide (CID 169464873) is N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide.
What is the SMILES notation for N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide?
The canonical SMILES for N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide is CC(=O)NCC=Cc1cccnc1N.
What is the InChIKey of N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide?
The InChIKey is BUDPVLMZTXAWAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-8(14)12-6-2-4-9-5-3-7-13-10(9)11/h2-5,7H,6H2,1H3,(H2,11,13)(H,12,14).
What are the key properties of N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide?
N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide has a molecular weight of 191.23 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-amino-3-pyridinyl)prop-2-enyl]acetamide is sourced from PubChem (CID 169464873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).