N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide

C23H28N2O3 — CID 55792744

IUPACN-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide
SMILESCc1ccc(C(C)C)c(OC(C)C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C23H28N2O3/c1-14(2)20-11-8-15(3)12-21(20)28-16(4)22(26)25-19-7-5-6-17(13-19)23(27)24-18-9-10-18/h5-8,11-14,16,18H,9-10H2,1-4H3,(H,24,27)(H,25,26)
InChIKeyFYMGTCPBRARSQP-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.42
Rot. Bonds7

About N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide

N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide (PubChem CID 55792744) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide
PubChem CID55792744
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC NameN-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide
SMILESCc1ccc(C(C)C)c(OC(C)C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C23H28N2O3/c1-14(2)20-11-8-15(3)12-21(20)28-16(4)22(26)25-19-7-5-6-17(13-19)23(27)24-18-9-10-18/h5-8,11-14,16,18H,9-10H2,1-4H3,(H,24,27)(H,25,26)
InChIKeyFYMGTCPBRARSQP-UHFFFAOYSA-N
XLogP4.42
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[(2S)-2-(4-chloro-2-methylphenoxy)propanoyl]amino]-N-cyclopropylbenzamide
CID 30126849
(2R)-N-(3-methoxyphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 95310662
3-[[(2S)-2-aminopropanoyl]amino]-N-cyclopropylbenzamide
CID 78969031
N-cyclopropyl-3-[[(2S)-2-(4-methylphenyl)sulfanylpropanoyl]amino]benzamide
CID 26110887
N-cyclopropyl-3-[2-(4-methylphenyl)sulfanylpropanoylamino]benzamide
CID 42894673
N-cyclopropyl-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide
CID 24581450
N-(3,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133219312
(2S)-N-[3-[ethylcarbamoyl(methyl)amino]phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100629956
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133160353
N-benzyl-3-[2-(2,5-dimethylphenoxy)propanoylamino]benzamide
CID 43887128
(2R)-N-(2-benzoylphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100679238
ethyl 3-[[(2R)-2-(2,5-dimethylphenoxy)propanoyl]amino]benzoate
CID 95078439

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide?
The IUPAC name of N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide (CID 55792744) is N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide.
What is the SMILES notation for N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide?
The canonical SMILES for N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide is Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1.
What is the InChIKey of N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide?
The InChIKey is FYMGTCPBRARSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-14(2)20-11-8-15(3)12-21(20)28-16(4)22(26)25-19-7-5-6-17(13-19)23(27)24-18-9-10-18/h5-8,11-14,16,18H,9-10H2,1-4H3,(H,24,27)(H,25,26).
What are the key properties of N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide?
N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide has a molecular weight of 380.49 g/mol, XLogP of 4.42, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzamide is sourced from PubChem (CID 55792744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).