N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide

C19H22ClNO2 — CID 95777310

IUPACN-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide
SMILESCO[C@@H](CNC(=O)CCc1cccc(C)c1)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO2/c1-14-4-3-5-15(12-14)6-11-19(22)21-13-18(23-2)16-7-9-17(20)10-8-16/h3-5,7-10,12,18H,6,11,13H2,1-2H3,(H,21,22)/t18-/m0/s1
InChIKeyIGYUWFCLOAPNFT-SFHVURJKSA-N
MW331.84 g/mol
LogP4.08
Rot. Bonds7

About N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide

N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide (PubChem CID 95777310) has the molecular formula C19H22ClNO2 and a molecular weight of 331.84 g/mol. Its IUPAC name is N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide
PubChem CID95777310
Molecular FormulaC19H22ClNO2
Molecular Weight331.84 g/mol
Exact Mass331.13
IUPAC NameN-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide
SMILESCO[C@@H](CNC(=O)CCc1cccc(C)c1)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO2/c1-14-4-3-5-15(12-14)6-11-19(22)21-13-18(23-2)16-7-9-17(20)10-8-16/h3-5,7-10,12,18H,6,11,13H2,1-2H3,(H,21,22)/t18-/m0/s1
InChIKeyIGYUWFCLOAPNFT-SFHVURJKSA-N
XLogP4.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.84
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide
CID 95777311
N-(2-bromo-2-phenylethyl)-3-(3-methylphenyl)propanamide
CID 114308268
2-hydroxy-3-[3-(3-methylphenyl)propanoylamino]propanoic acid
CID 66165783
(2S)-2-hydroxy-3-[3-(3-methylphenyl)propanoylamino]propanoic acid
CID 114006419
N-[2-(3-fluorophenyl)-2-methoxyethyl]-3-phenylpropanamide
CID 90622906
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-phenylpropanamide
CID 90623282
N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride
CID 120832068
2-hydroxy-3-[3-(3-methylphenyl)propanoylamino]propanamide
CID 114152434
3-(4-chlorophenyl)-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]propanamide
CID 111115447
N-(3-aminopropyl)-3-(3-methylphenyl)propanamide;hydrochloride
CID 119404890
N-[2-(3-chlorophenyl)-2-methoxyethyl]-4-(methylamino)butanamide
CID 119807214
N-(3-bromopropyl)-3-(3-methylphenyl)propanamide
CID 62365535

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide?
The IUPAC name of N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide (CID 95777310) is N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide.
What is the SMILES notation for N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide?
The canonical SMILES for N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide is CO[C@@H](CNC(=O)CCc1cccc(C)c1)c1ccc(Cl)cc1.
What is the InChIKey of N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide?
The InChIKey is IGYUWFCLOAPNFT-SFHVURJKSA-N. The full InChI is InChI=1S/C19H22ClNO2/c1-14-4-3-5-15(12-14)6-11-19(22)21-13-18(23-2)16-7-9-17(20)10-8-16/h3-5,7-10,12,18H,6,11,13H2,1-2H3,(H,21,22)/t18-/m0/s1.
What are the key properties of N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide?
N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide has a molecular weight of 331.84 g/mol, XLogP of 4.08, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-chlorophenyl)-2-methoxyethyl]-3-(3-methylphenyl)propanamide is sourced from PubChem (CID 95777310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).