4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide

C23H29NO — CID 73074312

IUPAC4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide
SMILESCCc1ccc(C(=O)N(CC(C)=Cc2ccccc2)CC(C)C)cc1
InChIInChI=1S/C23H29NO/c1-5-20-11-13-22(14-12-20)23(25)24(16-18(2)3)17-19(4)15-21-9-7-6-8-10-21/h6-15,18H,5,16-17H2,1-4H3
InChIKeyFTLPXORBCCKUOD-UHFFFAOYSA-N
MW335.49 g/mol
LogP5.45
Rot. Bonds7

About 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide

4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide (PubChem CID 73074312) has the molecular formula C23H29NO and a molecular weight of 335.49 g/mol. Its IUPAC name is 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide
PubChem CID73074312
Molecular FormulaC23H29NO
Molecular Weight335.49 g/mol
Exact Mass335.22
IUPAC Name4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide
SMILESCCc1ccc(C(=O)N(CC(C)=Cc2ccccc2)CC(C)C)cc1
InChIInChI=1S/C23H29NO/c1-5-20-11-13-22(14-12-20)23(25)24(16-18(2)3)17-19(4)15-21-9-7-6-8-10-21/h6-15,18H,5,16-17H2,1-4H3
InChIKeyFTLPXORBCCKUOD-UHFFFAOYSA-N
XLogP5.45
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.49
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide
CID 85152203
N-[(E)-2-methyl-3-phenylprop-2-enyl]-N-(2-methylpropyl)-3-phenylpropanamide
CID 42702375
2-(4-methoxyphenyl)-N-[(E)-2-methyl-3-phenylprop-2-enyl]-N-(2-methylpropyl)acetamide
CID 42702376
4-ethyl-N-[(E)-2-methyl-3-phenylprop-2-enyl]-N-(3-morpholin-4-ylpropyl)benzamide
CID 10250791
N-[2-[benzyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-4-ethyl-N-(2-methylpropyl)benzamide
CID 3670156
N-[2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-4-ethyl-N-(2-methylpropyl)benzamide
CID 4106870
1-N,1-N,4-N,4-N-tetrakis(2-methylpropyl)benzene-1,4-dicarboxamide
CID 3616296
4-ethyl-N-[2-[furan-2-ylmethyl(2-phenylethyl)amino]-2-oxoethyl]-N-(2-methylpropyl)benzamide
CID 4030396
(E)-2-(4-ethylphenyl)-3-phenylprop-2-enoic acid
CID 125466600
N-benzyl-2-chloro-N-[(E)-2-methyl-3-phenylprop-2-enyl]benzamide
CID 42657096
4-ethyl-N-(2-methylpropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide
CID 813708
N-(2-methyl-3-phenylprop-2-enyl)-N-propan-2-ylpropanamide
CID 76600128

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide?
The IUPAC name of 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide (CID 73074312) is 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide?
The canonical SMILES for 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide is CCc1ccc(C(=O)N(CC(C)=Cc2ccccc2)CC(C)C)cc1.
What is the InChIKey of 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide?
The InChIKey is FTLPXORBCCKUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO/c1-5-20-11-13-22(14-12-20)23(25)24(16-18(2)3)17-19(4)15-21-9-7-6-8-10-21/h6-15,18H,5,16-17H2,1-4H3.
What are the key properties of 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide?
4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide has a molecular weight of 335.49 g/mol, XLogP of 5.45, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(2-methyl-3-phenylprop-2-enyl)-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 73074312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).