N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide

C20H23NO3 — CID 126798924

IUPACN-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
SMILESCOc1cc(OC)cc(N(C)C(=O)C[C@@H]2C[C@H]2c2ccccc2)c1
InChIInChI=1S/C20H23NO3/c1-21(16-11-17(23-2)13-18(12-16)24-3)20(22)10-15-9-19(15)14-7-5-4-6-8-14/h4-8,11-13,15,19H,9-10H2,1-3H3/t15-,19-/m0/s1
InChIKeyIYPRYRSZIRXJCJ-KXBFYZLASA-N
MW325.41 g/mol
LogP3.86
Rot. Bonds6

About N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide

N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide (PubChem CID 126798924) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
PubChem CID126798924
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC NameN-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
SMILESCOc1cc(OC)cc(N(C)C(=O)C[C@@H]2C[C@H]2c2ccccc2)c1
InChIInChI=1S/C20H23NO3/c1-21(16-11-17(23-2)13-18(12-16)24-3)20(22)10-15-9-19(15)14-7-5-4-6-8-14/h4-8,11-13,15,19H,9-10H2,1-3H3/t15-,19-/m0/s1
InChIKeyIYPRYRSZIRXJCJ-KXBFYZLASA-N
XLogP3.86
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
CID 126811243
1-methoxy-3-(2-phenylcyclopropyl)propan-2-one
CID 161462275
2-chloro-N-(3,5-dimethoxyphenyl)-N-methylacetamide
CID 166414676
(3R)-3-amino-3-(3-methoxyphenyl)-N-methyl-N-[[(1R,2R)-2-phenylcyclopropyl]methyl]propanamide
CID 70218111
3-(3-methoxy-N-methylanilino)-3-oxopropanoic acid
CID 22132899
2-hydroxy-N-(3-methoxyphenyl)-N-methylacetamide
CID 70581132
2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]-N-methyl-N-phenylacetamide
CID 120762003
[(1S,2R)-2-(4-methoxyphenyl)cyclopropyl]methyl-triphenylsilane
CID 12030132
[(1S,2S)-2-(4-methoxyphenyl)cyclopropyl]methyl-triphenylsilane
CID 101060034
[methoxycarbonyl-[[(1S,2S)-2-phenylcyclopropyl]methyl]amino] methyl carbonate
CID 10423720
2-[(1S,2R)-2-(4-methoxyphenyl)cyclopropyl]-1-[4-(pyridine-2-carbonyl)piperazin-1-yl]ethanone
CID 138034046
[(1R)-2-(4-methoxyphenyl)cyclopropyl]methanol
CID 130347062

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide (CID 126798924) is N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide is COc1cc(OC)cc(N(C)C(=O)C[C@@H]2C[C@H]2c2ccccc2)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
The InChIKey is IYPRYRSZIRXJCJ-KXBFYZLASA-N. The full InChI is InChI=1S/C20H23NO3/c1-21(16-11-17(23-2)13-18(12-16)24-3)20(22)10-15-9-19(15)14-7-5-4-6-8-14/h4-8,11-13,15,19H,9-10H2,1-3H3/t15-,19-/m0/s1.
What are the key properties of N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide has a molecular weight of 325.41 g/mol, XLogP of 3.86, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide is sourced from PubChem (CID 126798924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).