N-acetyl-N-[(E)-prop-1-enyl]acetamide

C7H11NO2 — CID 12626388

IUPACN-acetyl-N-[(E)-prop-1-enyl]acetamide
SMILESC/C=C/N(C(C)=O)C(C)=O
InChIInChI=1S/C7H11NO2/c1-4-5-8(6(2)9)7(3)10/h4-5H,1-3H3/b5-4+
InChIKeyRVBDIVPROLVQTN-SNAWJCMRSA-N
MW141.17 g/mol
LogP0.92
Rot. Bonds1

About N-acetyl-N-[(E)-prop-1-enyl]acetamide

N-acetyl-N-[(E)-prop-1-enyl]acetamide (PubChem CID 12626388) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is N-acetyl-N-[(E)-prop-1-enyl]acetamide.

Molecular Properties

Compound NameN-acetyl-N-[(E)-prop-1-enyl]acetamide
PubChem CID12626388
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC NameN-acetyl-N-[(E)-prop-1-enyl]acetamide
SMILESC/C=C/N(C(C)=O)C(C)=O
InChIInChI=1S/C7H11NO2/c1-4-5-8(6(2)9)7(3)10/h4-5H,1-3H3/b5-4+
InChIKeyRVBDIVPROLVQTN-SNAWJCMRSA-N
XLogP0.92
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-acetyl-N-[(E)-prop-1-enyl]acetamide?
The IUPAC name of N-acetyl-N-[(E)-prop-1-enyl]acetamide (CID 12626388) is N-acetyl-N-[(E)-prop-1-enyl]acetamide.
What is the SMILES notation for N-acetyl-N-[(E)-prop-1-enyl]acetamide?
The canonical SMILES for N-acetyl-N-[(E)-prop-1-enyl]acetamide is C/C=C/N(C(C)=O)C(C)=O.
What is the InChIKey of N-acetyl-N-[(E)-prop-1-enyl]acetamide?
The InChIKey is RVBDIVPROLVQTN-SNAWJCMRSA-N. The full InChI is InChI=1S/C7H11NO2/c1-4-5-8(6(2)9)7(3)10/h4-5H,1-3H3/b5-4+.
What are the key properties of N-acetyl-N-[(E)-prop-1-enyl]acetamide?
N-acetyl-N-[(E)-prop-1-enyl]acetamide has a molecular weight of 141.17 g/mol, XLogP of 0.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-N-[(E)-prop-1-enyl]acetamide is sourced from PubChem (CID 12626388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).