N-[(E)-pentadec-2-enyl]acetamide

C17H33NO — CID 118028495

IUPACN-[(E)-pentadec-2-enyl]acetamide
SMILESCCCCCCCCCCCC/C=C/CNC(C)=O
InChIInChI=1S/C17H33NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-17(2)19/h14-15H,3-13,16H2,1-2H3,(H,18,19)/b15-14+
InChIKeyQWEIYZVQCRXBKK-CCEZHUSRSA-N
MW267.46 g/mol
LogP4.99
Rot. Bonds13

About N-[(E)-pentadec-2-enyl]acetamide

N-[(E)-pentadec-2-enyl]acetamide (PubChem CID 118028495) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is N-[(E)-pentadec-2-enyl]acetamide.

Molecular Properties

Compound NameN-[(E)-pentadec-2-enyl]acetamide
PubChem CID118028495
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC NameN-[(E)-pentadec-2-enyl]acetamide
SMILESCCCCCCCCCCCC/C=C/CNC(C)=O
InChIInChI=1S/C17H33NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-17(2)19/h14-15H,3-13,16H2,1-2H3,(H,18,19)/b15-14+
InChIKeyQWEIYZVQCRXBKK-CCEZHUSRSA-N
XLogP4.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis[(E)-non-2-enyl]hexanediamide
CID 101279958
acetic acid;(E)-tetradec-7-ene
CID 174697247
(E)-4-[[(E)-non-2-enyl]amino]-4-oxobut-2-enoic acid
CID 101277167
carbonic acid;(Z)-octadec-9-ene
CID 87599003
N-[(E)-dec-1-enyl]acetamide
CID 87894534
1-[(Z)-octadec-9-enyl]-3-[6-[[(Z)-octadec-9-enyl]carbamoylamino]hexyl]urea
CID 159541193
N,N'-bis[(E)-hept-2-enyl]hexanediamide
CID 101279945
acetic acid;(Z)-dec-3-ene
CID 174912778
(Z)-heptadec-7-en-2-one
CID 90307080
(E)-heptadec-5-en-2-one
CID 87291834
(E)-dotriacont-23-en-2-one
CID 5365248
(Z)-pentacos-16-en-2-one
CID 90307095

Frequently Asked Questions

What is the IUPAC name of N-[(E)-pentadec-2-enyl]acetamide?
The IUPAC name of N-[(E)-pentadec-2-enyl]acetamide (CID 118028495) is N-[(E)-pentadec-2-enyl]acetamide.
What is the SMILES notation for N-[(E)-pentadec-2-enyl]acetamide?
The canonical SMILES for N-[(E)-pentadec-2-enyl]acetamide is CCCCCCCCCCCC/C=C/CNC(C)=O.
What is the InChIKey of N-[(E)-pentadec-2-enyl]acetamide?
The InChIKey is QWEIYZVQCRXBKK-CCEZHUSRSA-N. The full InChI is InChI=1S/C17H33NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-17(2)19/h14-15H,3-13,16H2,1-2H3,(H,18,19)/b15-14+.
What are the key properties of N-[(E)-pentadec-2-enyl]acetamide?
N-[(E)-pentadec-2-enyl]acetamide has a molecular weight of 267.46 g/mol, XLogP of 4.99, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-pentadec-2-enyl]acetamide is sourced from PubChem (CID 118028495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).