N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide

C21H24N2O5 — CID 7944484

IUPACN-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide
SMILESCOc1cc(CC(=O)Nc2ccccc2C(=O)NC2CC2)cc(OC)c1OC
InChIInChI=1S/C21H24N2O5/c1-26-17-10-13(11-18(27-2)20(17)28-3)12-19(24)23-16-7-5-4-6-15(16)21(25)22-14-8-9-14/h4-7,10-11,14H,8-9,12H2,1-3H3,(H,22,25)(H,23,24)
InChIKeyUNNDZUYPFXJCPW-UHFFFAOYSA-N
MW384.43 g/mol
LogP2.79
Rot. Bonds8

About N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide

N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide (PubChem CID 7944484) has the molecular formula C21H24N2O5 and a molecular weight of 384.43 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide
PubChem CID7944484
Molecular FormulaC21H24N2O5
Molecular Weight384.43 g/mol
Exact Mass384.17
IUPAC NameN-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide
SMILESCOc1cc(CC(=O)Nc2ccccc2C(=O)NC2CC2)cc(OC)c1OC
InChIInChI=1S/C21H24N2O5/c1-26-17-10-13(11-18(27-2)20(17)28-3)12-19(24)23-16-7-5-4-6-15(16)21(25)22-14-8-9-14/h4-7,10-11,14H,8-9,12H2,1-3H3,(H,22,25)(H,23,24)
InChIKeyUNNDZUYPFXJCPW-UHFFFAOYSA-N
XLogP2.79
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-aminoethyl)-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide;hydrochloride
CID 120604529
N-cyclohexyl-2-[[2-(2-methoxyphenyl)acetyl]amino]benzamide
CID 17320235
N-cyclopropyl-2-[[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]benzamide
CID 7944497
N-(2-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2599423
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]-[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium
CID 8583964
2-(butanoylamino)-N-cyclopropylbenzamide
CID 31824279
N-cyclopropyl-2-[3-(3,5-dimethoxyphenyl)propanoylamino]benzamide
CID 26707492
2-[2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]acetic acid
CID 119218478
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]-[(2,4-dimethoxyphenyl)methyl]-methylazanium
CID 9101114
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 2,5-dimethoxybenzoate
CID 7587081
2-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethoxy]acetic acid
CID 60662463
N-[2-(dimethylamino)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 30875501

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide (CID 7944484) is N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide is COc1cc(CC(=O)Nc2ccccc2C(=O)NC2CC2)cc(OC)c1OC.
What is the InChIKey of N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide?
The InChIKey is UNNDZUYPFXJCPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O5/c1-26-17-10-13(11-18(27-2)20(17)28-3)12-19(24)23-16-7-5-4-6-15(16)21(25)22-14-8-9-14/h4-7,10-11,14H,8-9,12H2,1-3H3,(H,22,25)(H,23,24).
What are the key properties of N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide?
N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide has a molecular weight of 384.43 g/mol, XLogP of 2.79, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]benzamide is sourced from PubChem (CID 7944484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).