(2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide

C19H23NO3 — CID 28574627

IUPAC(2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide
SMILESCC[C@H](NC(=O)[C@H](C)Oc1cccc(OC)c1)c1ccccc1
InChIInChI=1S/C19H23NO3/c1-4-18(15-9-6-5-7-10-15)20-19(21)14(2)23-17-12-8-11-16(13-17)22-3/h5-14,18H,4H2,1-3H3,(H,20,21)/t14-,18-/m0/s1
InChIKeyCWQYRUDHXITVEJ-KSSFIOAISA-N
MW313.40 g/mol
LogP3.73
Rot. Bonds7

About (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide

(2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide (PubChem CID 28574627) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide.

Molecular Properties

Compound Name(2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide
PubChem CID28574627
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name(2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide
SMILESCC[C@H](NC(=O)[C@H](C)Oc1cccc(OC)c1)c1ccccc1
InChIInChI=1S/C19H23NO3/c1-4-18(15-9-6-5-7-10-15)20-19(21)14(2)23-17-12-8-11-16(13-17)22-3/h5-14,18H,4H2,1-3H3,(H,20,21)/t14-,18-/m0/s1
InChIKeyCWQYRUDHXITVEJ-KSSFIOAISA-N
XLogP3.73
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(3-methoxyphenoxy)propanamide
CID 133186771
2-(3-methoxyphenoxy)-N-[(1S)-1-phenylethyl]propanamide
CID 133144163
2-(4-chlorophenoxy)-N-(1-phenylpropyl)propanamide
CID 43911516
(2R)-2-(4-chloro-3,5-dimethylphenoxy)-N-[(1S)-1-phenylpropyl]propanamide
CID 30394470
2-(4-chloro-3,5-dimethylphenoxy)-N-(1-phenylpropyl)propanamide
CID 17328049
(2S)-2-(2-methylphenoxy)-N-[(1R)-1-phenylpropyl]propanamide
CID 93234565
(2S)-2-(3-methoxyphenoxy)-N-[(2S)-pentan-2-yl]propanamide
CID 99953946
(2R)-2-(3-methoxyphenoxy)-N-[(S)-(4-methylphenyl)-phenylmethyl]propanamide
CID 28569116
(2S)-N-[(1S)-1-phenylpropyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100672901
2-[2-(3-methoxyphenoxy)propanoylamino]propanoic acid
CID 53264145
(2R)-N-[(1R)-1-(4-methoxyphenyl)propyl]-2-(4-methylphenoxy)propanamide
CID 28956661
(2R)-N-[(1R)-3-methyl-1-phenylbutyl]-2-phenoxypropanamide
CID 41198910

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide?
The IUPAC name of (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide (CID 28574627) is (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide.
What is the SMILES notation for (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide?
The canonical SMILES for (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide is CC[C@H](NC(=O)[C@H](C)Oc1cccc(OC)c1)c1ccccc1.
What is the InChIKey of (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide?
The InChIKey is CWQYRUDHXITVEJ-KSSFIOAISA-N. The full InChI is InChI=1S/C19H23NO3/c1-4-18(15-9-6-5-7-10-15)20-19(21)14(2)23-17-12-8-11-16(13-17)22-3/h5-14,18H,4H2,1-3H3,(H,20,21)/t14-,18-/m0/s1.
What are the key properties of (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide?
(2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide has a molecular weight of 313.40 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(3-methoxyphenoxy)-N-[(1S)-1-phenylpropyl]propanamide is sourced from PubChem (CID 28574627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).