N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide

C10H11NO2 — CID 5352006

IUPACN-[(E)-2-(4-methoxyphenyl)ethenyl]formamide
SMILESCOc1ccc(/C=C/NC=O)cc1
InChIInChI=1S/C10H11NO2/c1-13-10-4-2-9(3-5-10)6-7-11-8-12/h2-8H,1H3,(H,11,12)/b7-6+
InChIKeySZCZSKMCTGEJKI-VOTSOKGWSA-N
MW177.20 g/mol
LogP1.41
Rot. Bonds4

About N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide

N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide (PubChem CID 5352006) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide.

Molecular Properties

Compound NameN-[(E)-2-(4-methoxyphenyl)ethenyl]formamide
PubChem CID5352006
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC NameN-[(E)-2-(4-methoxyphenyl)ethenyl]formamide
SMILESCOc1ccc(/C=C/NC=O)cc1
InChIInChI=1S/C10H11NO2/c1-13-10-4-2-9(3-5-10)6-7-11-8-12/h2-8H,1H3,(H,11,12)/b7-6+
InChIKeySZCZSKMCTGEJKI-VOTSOKGWSA-N
XLogP1.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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trans-4-Methoxy-beta-nitrostyrene
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Tmppaa
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4-Methoxy-beta-nitrostyrene
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N,N'-((1Z,3Z)-1,4-Bis(4-Methoxyphenyl)Buta-1,3-Diene-2,3-Diyl)Diformamide
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WF-5239
CID 6439891
3-(4-Methoxyphenyl)propan-1-amine
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2-[(4-Methoxyphenyl)methyl]buta-2,3-dien-1-amine
CID 19894373
N-(2-(4-Methoxyphenyl)ethyl)acetamide
CID 584258
Benzonitrile, 4-(((methylamino)carbonyl)oxy)-
CID 87581
Carbamic acid, dimethyl-, p-tolyl ester
CID 138981

Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide?
The IUPAC name of N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide (CID 5352006) is N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide.
What is the SMILES notation for N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide?
The canonical SMILES for N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide is COc1ccc(/C=C/NC=O)cc1.
What is the InChIKey of N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide?
The InChIKey is SZCZSKMCTGEJKI-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H11NO2/c1-13-10-4-2-9(3-5-10)6-7-11-8-12/h2-8H,1H3,(H,11,12)/b7-6+.
What are the key properties of N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide?
N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide has a molecular weight of 177.20 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2-(4-methoxyphenyl)ethenyl]formamide is sourced from PubChem (CID 5352006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).