N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide

C23H32N2O3 — CID 46447662

IUPACN-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide
SMILESCCN(CC)C(CNC(=O)C(C)Oc1ccc(OC)cc1)Cc1ccccc1
InChIInChI=1S/C23H32N2O3/c1-5-25(6-2)20(16-19-10-8-7-9-11-19)17-24-23(26)18(3)28-22-14-12-21(27-4)13-15-22/h7-15,18,20H,5-6,16-17H2,1-4H3,(H,24,26)
InChIKeyWYONLNFMKHNLKY-UHFFFAOYSA-N
MW384.52 g/mol
LogP3.53
Rot. Bonds11

About N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide

N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide (PubChem CID 46447662) has the molecular formula C23H32N2O3 and a molecular weight of 384.52 g/mol. Its IUPAC name is N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide
PubChem CID46447662
Molecular FormulaC23H32N2O3
Molecular Weight384.52 g/mol
Exact Mass384.24
IUPAC NameN-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide
SMILESCCN(CC)C(CNC(=O)C(C)Oc1ccc(OC)cc1)Cc1ccccc1
InChIInChI=1S/C23H32N2O3/c1-5-25(6-2)20(16-19-10-8-7-9-11-19)17-24-23(26)18(3)28-22-14-12-21(27-4)13-15-22/h7-15,18,20H,5-6,16-17H2,1-4H3,(H,24,26)
InChIKeyWYONLNFMKHNLKY-UHFFFAOYSA-N
XLogP3.53
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.52
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(diethylamino)-3-phenylpropyl]-3-phenylpropanamide
CID 119849948
(2S)-N-[(4-methoxyphenyl)methyl]-2-phenoxypropanamide
CID 831480
(2S)-N-(2-benzylsulfanylethyl)-2-(4-methoxyphenoxy)propanamide
CID 42115635
(2S)-2-amino-N-[2-(4-methoxyphenoxy)propyl]-3-phenylpropanamide;hydrochloride
CID 119290472
3-(diethylamino)-4-(4-methoxyphenyl)butanoic acid
CID 82352334
(2S)-N-butyl-2-(4-methoxyphenoxy)propanamide
CID 42082748
3-[[(2R)-2-(4-methoxyphenoxy)propanoyl]amino]propanoic acid
CID 93306205
N-ethyl-2-phenoxypropanamide
CID 4282518
(2R)-2-phenoxy-N-[2-[[(2R)-2-phenoxypropanoyl]amino]ethyl]propanamide
CID 7039405
N-[2-(diethylamino)-3-phenylpropyl]-3-(3,4,5-trimethoxyphenyl)propanamide
CID 43067524
2-(4-methoxyphenoxy)-N-(3-methylbutyl)propanamide
CID 21173373
N-[2-(dimethylamino)-3-phenylpropyl]-3-(4-methoxyphenyl)propanamide
CID 51186444

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide?
The IUPAC name of N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide (CID 46447662) is N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide?
The canonical SMILES for N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide is CCN(CC)C(CNC(=O)C(C)Oc1ccc(OC)cc1)Cc1ccccc1.
What is the InChIKey of N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide?
The InChIKey is WYONLNFMKHNLKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O3/c1-5-25(6-2)20(16-19-10-8-7-9-11-19)17-24-23(26)18(3)28-22-14-12-21(27-4)13-15-22/h7-15,18,20H,5-6,16-17H2,1-4H3,(H,24,26).
What are the key properties of N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide?
N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide has a molecular weight of 384.52 g/mol, XLogP of 3.53, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-3-phenylpropyl]-2-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 46447662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).