ethane;N-(4-ethenylphenyl)formamide

C11H15NO — CID 143911440

IUPACethane;N-(4-ethenylphenyl)formamide
SMILESC=Cc1ccc(NC=O)cc1.CC
InChIInChI=1S/C9H9NO.C2H6/c1-2-8-3-5-9(6-4-8)10-7-11;1-2/h2-7H,1H2,(H,10,11);1-2H3
InChIKeyFMQDQCGVXBBMSX-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.92
Rot. Bonds3

About ethane;N-(4-ethenylphenyl)formamide

ethane;N-(4-ethenylphenyl)formamide (PubChem CID 143911440) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is ethane;N-(4-ethenylphenyl)formamide.

Molecular Properties

Compound Nameethane;N-(4-ethenylphenyl)formamide
PubChem CID143911440
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Nameethane;N-(4-ethenylphenyl)formamide
SMILESC=Cc1ccc(NC=O)cc1.CC
InChIInChI=1S/C9H9NO.C2H6/c1-2-8-3-5-9(6-4-8)10-7-11;1-2/h2-7H,1H2,(H,10,11);1-2H3
InChIKeyFMQDQCGVXBBMSX-UHFFFAOYSA-N
XLogP2.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,4-bis(ethenyl)aniline
CID 21060901
N-(4-formylphenyl)formamide
CID 15314216
ethane;N-(4-methylphenyl)formamide
CID 142066401
ethane;4-ethenylbenzaldehyde;methanol
CID 145257889
ethane;N-(4-hydroxyphenyl)formamide;methanamine
CID 145229488
N-[4-(4-methylphenyl)phenyl]formamide
CID 87370886
N-(5-ethenyl-2-pyridinyl)formamide
CID 87078462
N-(4-bromophenyl)formamide;methane
CID 163289567
N-[4-[bis(4-formamidophenyl)methyl]phenyl]formamide
CID 22490733
(4-ethenylphenyl)carbamic acid
CID 22352089
bis(1-ethenyl-4-methylbenzene);formaldehyde
CID 144930982
1-bromo-4-ethenylbenzene;ethane
CID 144688744

Frequently Asked Questions

What is the IUPAC name of ethane;N-(4-ethenylphenyl)formamide?
The IUPAC name of ethane;N-(4-ethenylphenyl)formamide (CID 143911440) is ethane;N-(4-ethenylphenyl)formamide.
What is the SMILES notation for ethane;N-(4-ethenylphenyl)formamide?
The canonical SMILES for ethane;N-(4-ethenylphenyl)formamide is C=Cc1ccc(NC=O)cc1.CC.
What is the InChIKey of ethane;N-(4-ethenylphenyl)formamide?
The InChIKey is FMQDQCGVXBBMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO.C2H6/c1-2-8-3-5-9(6-4-8)10-7-11;1-2/h2-7H,1H2,(H,10,11);1-2H3.
What are the key properties of ethane;N-(4-ethenylphenyl)formamide?
ethane;N-(4-ethenylphenyl)formamide has a molecular weight of 177.25 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(4-ethenylphenyl)formamide is sourced from PubChem (CID 143911440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).