N-[(E)-prop-1-enyl]propanamide

C6H11NO — CID 143238282

IUPACN-[(E)-prop-1-enyl]propanamide
SMILESC/C=C/NC(=O)CC
InChIInChI=1S/C6H11NO/c1-3-5-7-6(8)4-2/h3,5H,4H2,1-2H3,(H,7,8)/b5-3+
InChIKeyPMAGOSMOWNMBRX-HWKANZROSA-N
MW113.16 g/mol
LogP1.05
Rot. Bonds2

About N-[(E)-prop-1-enyl]propanamide

N-[(E)-prop-1-enyl]propanamide (PubChem CID 143238282) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is N-[(E)-prop-1-enyl]propanamide.

Molecular Properties

Compound NameN-[(E)-prop-1-enyl]propanamide
PubChem CID143238282
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC NameN-[(E)-prop-1-enyl]propanamide
SMILESC/C=C/NC(=O)CC
InChIInChI=1S/C6H11NO/c1-3-5-7-6(8)4-2/h3,5H,4H2,1-2H3,(H,7,8)/b5-3+
InChIKeyPMAGOSMOWNMBRX-HWKANZROSA-N
XLogP1.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-prop-1-enyl]propanamide?
The IUPAC name of N-[(E)-prop-1-enyl]propanamide (CID 143238282) is N-[(E)-prop-1-enyl]propanamide.
What is the SMILES notation for N-[(E)-prop-1-enyl]propanamide?
The canonical SMILES for N-[(E)-prop-1-enyl]propanamide is C/C=C/NC(=O)CC.
What is the InChIKey of N-[(E)-prop-1-enyl]propanamide?
The InChIKey is PMAGOSMOWNMBRX-HWKANZROSA-N. The full InChI is InChI=1S/C6H11NO/c1-3-5-7-6(8)4-2/h3,5H,4H2,1-2H3,(H,7,8)/b5-3+.
What are the key properties of N-[(E)-prop-1-enyl]propanamide?
N-[(E)-prop-1-enyl]propanamide has a molecular weight of 113.16 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-prop-1-enyl]propanamide is sourced from PubChem (CID 143238282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).