3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide

C19H24N2O2 — CID 119695657

IUPAC3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide
SMILESCc1cccc(OCCN(C)C(=O)C(CN)c2ccccc2)c1
InChIInChI=1S/C19H24N2O2/c1-15-7-6-10-17(13-15)23-12-11-21(2)19(22)18(14-20)16-8-4-3-5-9-16/h3-10,13,18H,11-12,14,20H2,1-2H3
InChIKeyRKZXOAUTWQIASN-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.57
Rot. Bonds7

About 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide

3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide (PubChem CID 119695657) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide
PubChem CID119695657
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide
SMILESCc1cccc(OCCN(C)C(=O)C(CN)c2ccccc2)c1
InChIInChI=1S/C19H24N2O2/c1-15-7-6-10-17(13-15)23-12-11-21(2)19(22)18(14-20)16-8-4-3-5-9-16/h3-10,13,18H,11-12,14,20H2,1-2H3
InChIKeyRKZXOAUTWQIASN-UHFFFAOYSA-N
XLogP2.57
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]-2-phenylpropanamide
CID 119695605
3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-3-phenylpropanamide
CID 119949182
(2S)-2-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]butanamide;hydrochloride
CID 119274564
2-amino-4-methoxy-N-methyl-N-[2-(3-methylphenoxy)ethyl]butanamide
CID 62474656
3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]propanamide;hydrochloride
CID 119274543
4-amino-3-methoxy-N-methyl-N-[2-(3-methylphenoxy)ethyl]butanamide;hydrochloride
CID 120587503
5-amino-N,4-dimethyl-N-[2-(3-methylphenoxy)ethyl]pentanamide
CID 82011195
2-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]hexanamide
CID 60946640
propyl N-methyl-N-[2-(3-methylphenoxy)ethyl]carbamate
CID 112738751
N,2,2-trimethyl-N-[2-(3-methylphenoxy)ethyl]propanamide
CID 60676012
2-(aminomethyl)-N,3-dimethyl-N-(2-phenoxyethyl)butanamide
CID 65229723
2,2,2-trifluoro-N-methyl-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 62492492

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide?
The IUPAC name of 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide (CID 119695657) is 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide is Cc1cccc(OCCN(C)C(=O)C(CN)c2ccccc2)c1.
What is the InChIKey of 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide?
The InChIKey is RKZXOAUTWQIASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15-7-6-10-17(13-15)23-12-11-21(2)19(22)18(14-20)16-8-4-3-5-9-16/h3-10,13,18H,11-12,14,20H2,1-2H3.
What are the key properties of 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide?
3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide has a molecular weight of 312.41 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenylpropanamide is sourced from PubChem (CID 119695657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).