N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide

C16H16N2O — CID 130185155

IUPACN,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide
SMILESCN(C)C(=O)c1ccc(/C=C/c2ccncc2)cc1
InChIInChI=1S/C16H16N2O/c1-18(2)16(19)15-7-5-13(6-8-15)3-4-14-9-11-17-12-10-14/h3-12H,1-2H3/b4-3+
InChIKeyXLLACFUPMVMLND-ONEGZZNKSA-N
MW252.32 g/mol
LogP2.95
Rot. Bonds3

About N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide

N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide (PubChem CID 130185155) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide
PubChem CID130185155
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC NameN,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide
SMILESCN(C)C(=O)c1ccc(/C=C/c2ccncc2)cc1
InChIInChI=1S/C16H16N2O/c1-18(2)16(19)15-7-5-13(6-8-15)3-4-14-9-11-17-12-10-14/h3-12H,1-2H3/b4-3+
InChIKeyXLLACFUPMVMLND-ONEGZZNKSA-N
XLogP2.95
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-[4-[(E)-2-pyridin-4-ylethenyl]-N-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]anilino]benzoate
CID 24814387
4-[(E)-2-[4-(1,2,2-triphenylethenyl)phenyl]ethenyl]pyridine
CID 102493364
N-methyl-4-[(E)-2-[4-[methyl(phenyl)carbamoyl]phenyl]ethenyl]-N-phenylbenzamide
CID 134109031
methyl (E)-3-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]prop-2-enoate
CID 101358930
N,N-dimethylmethanamine;4-hydroxy-N,N-dimethylbenzamide
CID 143686918
4-[[(E)-3-(4-fluorophenyl)prop-2-enoyl]amino]-N,N-dimethylbenzamide
CID 7729326
3-[[(3-carboxyphenyl)-methylcarbamoyl]-methylamino]benzoic acid;4-[(E)-2-pyridin-4-ylethenyl]pyridine
CID 139146525
4-[(E)-3-(3-bromo-4-methylanilino)-3-oxoprop-1-enyl]-N,N-dimethylbenzamide
CID 110300748
(E)-1-(4-tert-butylphenyl)-3-pyridin-4-ylprop-2-en-1-one
CID 11777637
N,N-dimethyl-4-[(E)-3-(2-methylanilino)-3-oxoprop-1-enyl]benzamide
CID 110300711
4-[(1E,3E,5E)-6-pyridin-4-ylhexa-1,3,5-trienyl]pyridine
CID 139077080
4-[6-[4-[(E)-2-pyridin-4-ylethenyl]phenoxy]hexoxy]benzoic acid
CID 102014240

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide?
The IUPAC name of N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide (CID 130185155) is N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide is CN(C)C(=O)c1ccc(/C=C/c2ccncc2)cc1.
What is the InChIKey of N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide?
The InChIKey is XLLACFUPMVMLND-ONEGZZNKSA-N. The full InChI is InChI=1S/C16H16N2O/c1-18(2)16(19)15-7-5-13(6-8-15)3-4-14-9-11-17-12-10-14/h3-12H,1-2H3/b4-3+.
What are the key properties of N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide?
N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide has a molecular weight of 252.32 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(E)-2-pyridin-4-ylethenyl]benzamide is sourced from PubChem (CID 130185155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).