N-(1-pyridin-4-ylethenyl)acetamide

C9H10N2O — CID 131985991

IUPACN-(1-pyridin-4-ylethenyl)acetamide
SMILESC=C(NC(C)=O)c1ccncc1
InChIInChI=1S/C9H10N2O/c1-7(11-8(2)12)9-3-5-10-6-4-9/h3-6H,1H2,2H3,(H,11,12)
InChIKeyLWCMILHUWIUCPX-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.19
Rot. Bonds2

About N-(1-pyridin-4-ylethenyl)acetamide

N-(1-pyridin-4-ylethenyl)acetamide (PubChem CID 131985991) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is N-(1-pyridin-4-ylethenyl)acetamide.

Molecular Properties

Compound NameN-(1-pyridin-4-ylethenyl)acetamide
PubChem CID131985991
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC NameN-(1-pyridin-4-ylethenyl)acetamide
SMILESC=C(NC(C)=O)c1ccncc1
InChIInChI=1S/C9H10N2O/c1-7(11-8(2)12)9-3-5-10-6-4-9/h3-6H,1H2,2H3,(H,11,12)
InChIKeyLWCMILHUWIUCPX-UHFFFAOYSA-N
XLogP1.19
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-4-ylethenyl)acetamide?
The IUPAC name of N-(1-pyridin-4-ylethenyl)acetamide (CID 131985991) is N-(1-pyridin-4-ylethenyl)acetamide.
What is the SMILES notation for N-(1-pyridin-4-ylethenyl)acetamide?
The canonical SMILES for N-(1-pyridin-4-ylethenyl)acetamide is C=C(NC(C)=O)c1ccncc1.
What is the InChIKey of N-(1-pyridin-4-ylethenyl)acetamide?
The InChIKey is LWCMILHUWIUCPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-7(11-8(2)12)9-3-5-10-6-4-9/h3-6H,1H2,2H3,(H,11,12).
What are the key properties of N-(1-pyridin-4-ylethenyl)acetamide?
N-(1-pyridin-4-ylethenyl)acetamide has a molecular weight of 162.19 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-4-ylethenyl)acetamide is sourced from PubChem (CID 131985991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).