N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide

C22H30N2O3 — CID 8991941

IUPACN-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide
SMILESCCc1ccc([C@@H](NCC(=O)Nc2cc(OC)ccc2OC)C(C)C)cc1
InChIInChI=1S/C22H30N2O3/c1-6-16-7-9-17(10-8-16)22(15(2)3)23-14-21(25)24-19-13-18(26-4)11-12-20(19)27-5/h7-13,15,22-23H,6,14H2,1-5H3,(H,24,25)/t22-/m0/s1
InChIKeyAZVONPBQBXSBBD-QFIPXVFZSA-N
MW370.49 g/mol
LogP4.19
Rot. Bonds9

About N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide

N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide (PubChem CID 8991941) has the molecular formula C22H30N2O3 and a molecular weight of 370.49 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide
PubChem CID8991941
Molecular FormulaC22H30N2O3
Molecular Weight370.49 g/mol
Exact Mass370.23
IUPAC NameN-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide
SMILESCCc1ccc([C@@H](NCC(=O)Nc2cc(OC)ccc2OC)C(C)C)cc1
InChIInChI=1S/C22H30N2O3/c1-6-16-7-9-17(10-8-16)22(15(2)3)23-14-21(25)24-19-13-18(26-4)11-12-20(19)27-5/h7-13,15,22-23H,6,14H2,1-5H3,(H,24,25)/t22-/m0/s1
InChIKeyAZVONPBQBXSBBD-QFIPXVFZSA-N
XLogP4.19
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.49
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131563
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[[(1R)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide
CID 41291640
N-(5-acetamido-2-methoxyphenyl)-2-[[(1R)-2-methyl-1-(4-propylphenyl)propyl]amino]acetamide
CID 8971255
N-(5-acetamido-2-methoxyphenyl)-2-[[(1R)-1-[4-[(2R)-butan-2-yl]phenyl]-2-methylpropyl]amino]acetamide
CID 8834661
N-(2,5-dimethoxyphenyl)-2-[1-(4-phenylphenyl)ethylamino]acetamide
CID 17457335
N-(5-acetamido-2-methoxyphenyl)-2-[[(1S)-1-(4-tert-butylphenyl)-2-methylpropyl]amino]acetamide
CID 9129845
N-(2,5-dimethoxyphenyl)-2-(4-ethylanilino)propanamide
CID 51178496
N-(2,5-dimethoxyphenyl)-2-[(4-ethylphenyl)methyl-methylamino]acetamide
CID 8907896
N-(2,5-dimethoxyphenyl)-3-(ethylamino)butanamide
CID 60663324
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 8992802
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
CID 41023049

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide (CID 8991941) is N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide is CCc1ccc([C@@H](NCC(=O)Nc2cc(OC)ccc2OC)C(C)C)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide?
The InChIKey is AZVONPBQBXSBBD-QFIPXVFZSA-N. The full InChI is InChI=1S/C22H30N2O3/c1-6-16-7-9-17(10-8-16)22(15(2)3)23-14-21(25)24-19-13-18(26-4)11-12-20(19)27-5/h7-13,15,22-23H,6,14H2,1-5H3,(H,24,25)/t22-/m0/s1.
What are the key properties of N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide?
N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide has a molecular weight of 370.49 g/mol, XLogP of 4.19, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide is sourced from PubChem (CID 8991941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).