N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide

C19H23NO3 — CID 90623282

IUPACN-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide
SMILESCOc1cccc(C(CNC(=O)CCc2ccccc2)OC)c1
InChIInChI=1S/C19H23NO3/c1-22-17-10-6-9-16(13-17)18(23-2)14-20-19(21)12-11-15-7-4-3-5-8-15/h3-10,13,18H,11-12,14H2,1-2H3,(H,20,21)
InChIKeyBMLQVUDITXRFHY-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.13
Rot. Bonds8

About N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide

N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide (PubChem CID 90623282) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide
PubChem CID90623282
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide
SMILESCOc1cccc(C(CNC(=O)CCc2ccccc2)OC)c1
InChIInChI=1S/C19H23NO3/c1-22-17-10-6-9-16(13-17)18(23-2)14-20-19(21)12-11-15-7-4-3-5-8-15/h3-10,13,18H,11-12,14H2,1-2H3,(H,20,21)
InChIKeyBMLQVUDITXRFHY-UHFFFAOYSA-N
XLogP3.13
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide
CID 90622906
N-[2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide
CID 16811467
3-(4-fluorophenyl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]propanamide
CID 110663372
3-(4-chlorophenyl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]propanamide
CID 111115447
N-(2-hydroxy-3-phenylpropyl)-3-(3-methoxyphenyl)propanamide
CID 111102377
2-(4-fluorophenoxy)-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]acetamide
CID 90623316
N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-(4-ethylphenyl)propanamide
CID 43044979
3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
CID 127121905
N-[(2S)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenylbutanamide
CID 51947652
N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-3-(2-methylphenyl)propanamide
CID 110663371
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-2-[methyl(methylsulfonyl)amino]acetamide
CID 90623418
4-ethyl-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
CID 90623280

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide?
The IUPAC name of N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide (CID 90623282) is N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide?
The canonical SMILES for N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide is COc1cccc(C(CNC(=O)CCc2ccccc2)OC)c1.
What is the InChIKey of N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide?
The InChIKey is BMLQVUDITXRFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-22-17-10-6-9-16(13-17)18(23-2)14-20-19(21)12-11-15-7-4-3-5-8-15/h3-10,13,18H,11-12,14H2,1-2H3,(H,20,21).
What are the key properties of N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide?
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide has a molecular weight of 313.40 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide is sourced from PubChem (CID 90623282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).