2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide

C22H30N2O2 — CID 112798795

IUPAC2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide
SMILESCCC(NC(C)C(=O)NCC(C)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C22H30N2O2/c1-5-21(19-11-13-20(26-4)14-12-19)24-17(3)22(25)23-15-16(2)18-9-7-6-8-10-18/h6-14,16-17,21,24H,5,15H2,1-4H3,(H,23,25)
InChIKeyCYOYOWFVENBAFP-UHFFFAOYSA-N
MW354.49 g/mol
LogP4.04
Rot. Bonds9

About 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide

2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide (PubChem CID 112798795) has the molecular formula C22H30N2O2 and a molecular weight of 354.49 g/mol. Its IUPAC name is 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide.

Molecular Properties

Compound Name2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide
PubChem CID112798795
Molecular FormulaC22H30N2O2
Molecular Weight354.49 g/mol
Exact Mass354.23
IUPAC Name2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide
SMILESCCC(NC(C)C(=O)NCC(C)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C22H30N2O2/c1-5-21(19-11-13-20(26-4)14-12-19)24-17(3)22(25)23-15-16(2)18-9-7-6-8-10-18/h6-14,16-17,21,24H,5,15H2,1-4H3,(H,23,25)
InChIKeyCYOYOWFVENBAFP-UHFFFAOYSA-N
XLogP4.04
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.49
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-2-[1-(4-methoxyphenyl)propylamino]propanamide
CID 112771603
(2S)-2-(6-methoxynaphthalen-2-yl)-N-[(2R)-2-phenylpropyl]propanamide
CID 9427304
2-[1-(4-methoxyphenyl)propylamino]-N-[2-(3-methylphenoxy)ethyl]propanamide
CID 112811608
(2S)-2-(4-methoxyphenyl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide
CID 51546952
N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide
CID 55371775
2-(3-methoxyphenoxy)-N-(2-phenylpropyl)butanamide
CID 133240098
N-[1-(4-methoxyphenyl)propyl]-2-phenylbutanamide
CID 43027690
3-amino-N-[1-(4-methoxyphenyl)propyl]-2-methyl-3-phenylpropanamide
CID 119689348
(2R)-2-[2-(4-methoxyphenyl)propylamino]-2-phenylacetic acid
CID 122038070
2-(4-methoxyphenyl)sulfanyl-N-(2-phenylpropyl)acetamide
CID 78687555
(2S,3S)-2-amino-3-methyl-N-(2-phenylpropyl)pentanamide
CID 61251907
(2R)-2-(4-methoxy-N-methylsulfonylanilino)-N-[(2S)-2-phenylpropyl]propanamide
CID 125057687

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide?
The IUPAC name of 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide (CID 112798795) is 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide.
What is the SMILES notation for 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide?
The canonical SMILES for 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide is CCC(NC(C)C(=O)NCC(C)c1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide?
The InChIKey is CYOYOWFVENBAFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O2/c1-5-21(19-11-13-20(26-4)14-12-19)24-17(3)22(25)23-15-16(2)18-9-7-6-8-10-18/h6-14,16-17,21,24H,5,15H2,1-4H3,(H,23,25).
What are the key properties of 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide?
2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide has a molecular weight of 354.49 g/mol, XLogP of 4.04, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methoxyphenyl)propylamino]-N-(2-phenylpropyl)propanamide is sourced from PubChem (CID 112798795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).