N-ethyl-4-[(E)-pent-1-enyl]benzamide

C14H19NO — CID 11644211

IUPACN-ethyl-4-[(E)-pent-1-enyl]benzamide
SMILESCCC/C=C/c1ccc(C(=O)NCC)cc1
InChIInChI=1S/C14H19NO/c1-3-5-6-7-12-8-10-13(11-9-12)14(16)15-4-2/h6-11H,3-5H2,1-2H3,(H,15,16)/b7-6+
InChIKeyHOSHFEMXFVYISK-VOTSOKGWSA-N
MW217.31 g/mol
LogP3.25
Rot. Bonds5

About N-ethyl-4-[(E)-pent-1-enyl]benzamide

N-ethyl-4-[(E)-pent-1-enyl]benzamide (PubChem CID 11644211) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N-ethyl-4-[(E)-pent-1-enyl]benzamide.

Molecular Properties

Compound NameN-ethyl-4-[(E)-pent-1-enyl]benzamide
PubChem CID11644211
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN-ethyl-4-[(E)-pent-1-enyl]benzamide
SMILESCCC/C=C/c1ccc(C(=O)NCC)cc1
InChIInChI=1S/C14H19NO/c1-3-5-6-7-12-8-10-13(11-9-12)14(16)15-4-2/h6-11H,3-5H2,1-2H3,(H,15,16)/b7-6+
InChIKeyHOSHFEMXFVYISK-VOTSOKGWSA-N
XLogP3.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-3-[4-(ethylcarbamoyl)phenyl]prop-2-enoic acid
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N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide
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4-[(E)-pent-1-enyl]-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
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N-(3-imidazol-1-ylpropyl)-4-[(E)-pent-1-enyl]benzamide
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CID 70541790
N-[2-(2-hydroxyethyl)phenyl]-4-pent-1-enylbenzamide
CID 72790654
N-(2-chloro-3-pyridinyl)-4-[(E)-pent-1-enyl]benzamide
CID 59811361
4-[(E)-pent-1-enyl]phenol
CID 15576502
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CID 170489043
ethane;N-ethyl-4-hydroxybenzamide
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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(E)-pent-1-enyl]benzamide?
The IUPAC name of N-ethyl-4-[(E)-pent-1-enyl]benzamide (CID 11644211) is N-ethyl-4-[(E)-pent-1-enyl]benzamide.
What is the SMILES notation for N-ethyl-4-[(E)-pent-1-enyl]benzamide?
The canonical SMILES for N-ethyl-4-[(E)-pent-1-enyl]benzamide is CCC/C=C/c1ccc(C(=O)NCC)cc1.
What is the InChIKey of N-ethyl-4-[(E)-pent-1-enyl]benzamide?
The InChIKey is HOSHFEMXFVYISK-VOTSOKGWSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-5-6-7-12-8-10-13(11-9-12)14(16)15-4-2/h6-11H,3-5H2,1-2H3,(H,15,16)/b7-6+.
What are the key properties of N-ethyl-4-[(E)-pent-1-enyl]benzamide?
N-ethyl-4-[(E)-pent-1-enyl]benzamide has a molecular weight of 217.31 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(E)-pent-1-enyl]benzamide is sourced from PubChem (CID 11644211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).