N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane

C15H25NO2 — CID 159473718

IUPACN-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane
SMILESC.C.C=Cc1ccc(CN(CCO)C(C)=O)cc1
InChIInChI=1S/C13H17NO2.2CH4/c1-3-12-4-6-13(7-5-12)10-14(8-9-15)11(2)16;;/h3-7,15H,1,8-10H2,2H3;2*1H4
InChIKeyLWCPQHIXTVKQIQ-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.94
Rot. Bonds5

About N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane

N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane (PubChem CID 159473718) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane.

Molecular Properties

Compound NameN-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane
PubChem CID159473718
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane
SMILESC.C.C=Cc1ccc(CN(CCO)C(C)=O)cc1
InChIInChI=1S/C13H17NO2.2CH4/c1-3-12-4-6-13(7-5-12)10-14(8-9-15)11(2)16;;/h3-7,15H,1,8-10H2,2H3;2*1H4
InChIKeyLWCPQHIXTVKQIQ-UHFFFAOYSA-N
XLogP2.94
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol
CID 23569814
1-[(4-ethenylphenyl)methyl]-1-methylurea
CID 91376596
1-(4-ethenylphenyl)propan-2-one
CID 70398942
N-[2-[acetyl(benzyl)amino]ethyl]-N-benzylacetamide
CID 562449
N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 84572947
N,N-bis[(4-chlorophenyl)methyl]acetamide
CID 22660922
2-[4-ethenyl-N-(2-hydroxyethyl)anilino]ethanol
CID 69382190
4-[(E)-3-[benzyl(2-hydroxyethyl)amino]-2-methyl-3-oxoprop-1-enyl]benzoic acid
CID 10735824
4-ethyl-N-(2-hydroxyethyl)-N-prop-2-enylbenzamide
CID 113340627
5-ethenyl-1-N,1-N,3-N,3-N-tetrakis(2-hydroxyethyl)benzene-1,3-dicarboxamide
CID 170901578
1-ethenyl-4-(2-methylbut-2-enyl)benzene
CID 139941573
N-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)acetamide
CID 22660909

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane?
The IUPAC name of N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane (CID 159473718) is N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane.
What is the SMILES notation for N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane?
The canonical SMILES for N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane is C.C.C=Cc1ccc(CN(CCO)C(C)=O)cc1.
What is the InChIKey of N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane?
The InChIKey is LWCPQHIXTVKQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2.2CH4/c1-3-12-4-6-13(7-5-12)10-14(8-9-15)11(2)16;;/h3-7,15H,1,8-10H2,2H3;2*1H4.
What are the key properties of N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane?
N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane has a molecular weight of 251.37 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane is sourced from PubChem (CID 159473718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).