N-methyl-4,4-diphenylbut-3-enamide

C17H17NO — CID 10824648

IUPACN-methyl-4,4-diphenylbut-3-enamide
SMILESCNC(=O)CC=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H17NO/c1-18-17(19)13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-12H,13H2,1H3,(H,18,19)
InChIKeyRPFVNJPXTFQJSQ-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.25
Rot. Bonds4

About N-methyl-4,4-diphenylbut-3-enamide

N-methyl-4,4-diphenylbut-3-enamide (PubChem CID 10824648) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is N-methyl-4,4-diphenylbut-3-enamide.

Molecular Properties

Compound NameN-methyl-4,4-diphenylbut-3-enamide
PubChem CID10824648
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC NameN-methyl-4,4-diphenylbut-3-enamide
SMILESCNC(=O)CC=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H17NO/c1-18-17(19)13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-12H,13H2,1H3,(H,18,19)
InChIKeyRPFVNJPXTFQJSQ-UHFFFAOYSA-N
XLogP3.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-bis(3-acetamidophenyl)-N-methylbut-3-enamide
CID 23403007
(E)-1-(methylamino)-1-phenylpent-1-en-3-one
CID 121010171
(E)-4-(methylamino)-1-phenylpent-3-en-1-one
CID 121007705
(Z)-3-(methylamino)-3-phenylprop-2-enoic acid
CID 69082862
N-methyl-3,3-diphenylpropanamide
CID 3373592
[2-(methylamino)-2-oxoethyl] benzoate
CID 14033068
N-methylbenzamide
CID 11954
methyl 3-(4,4-diphenylbut-3-enylamino)propanoate
CID 71739732
N-(3,3-diphenylprop-2-enyl)hydroxylamine
CID 10775571
trimethyl(2,5,5-triphenylpenta-1,4-dienyl)silane
CID 601377
3,3-diphenylprop-2-ene-1-thiol
CID 87371964
(5S)-N,5-dimethyl-6-phenylhex-3-enamide
CID 57033478

Frequently Asked Questions

What is the IUPAC name of N-methyl-4,4-diphenylbut-3-enamide?
The IUPAC name of N-methyl-4,4-diphenylbut-3-enamide (CID 10824648) is N-methyl-4,4-diphenylbut-3-enamide.
What is the SMILES notation for N-methyl-4,4-diphenylbut-3-enamide?
The canonical SMILES for N-methyl-4,4-diphenylbut-3-enamide is CNC(=O)CC=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-methyl-4,4-diphenylbut-3-enamide?
The InChIKey is RPFVNJPXTFQJSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-18-17(19)13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-12H,13H2,1H3,(H,18,19).
What are the key properties of N-methyl-4,4-diphenylbut-3-enamide?
N-methyl-4,4-diphenylbut-3-enamide has a molecular weight of 251.33 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4,4-diphenylbut-3-enamide is sourced from PubChem (CID 10824648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).