N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide

C15H24N2O2 — CID 108993195

IUPACN-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide
SMILESCOc1cccc(CCNC(=O)CNCC(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-12(2)10-16-11-15(18)17-8-7-13-5-4-6-14(9-13)19-3/h4-6,9,12,16H,7-8,10-11H2,1-3H3,(H,17,18)
InChIKeyILJHGEJXUXNJKO-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.60
Rot. Bonds8

About N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide

N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide (PubChem CID 108993195) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide
PubChem CID108993195
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide
SMILESCOc1cccc(CCNC(=O)CNCC(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-12(2)10-16-11-15(18)17-8-7-13-5-4-6-14(9-13)19-3/h4-6,9,12,16H,7-8,10-11H2,1-3H3,(H,17,18)
InChIKeyILJHGEJXUXNJKO-UHFFFAOYSA-N
XLogP1.60
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-methoxyphenyl)ethyl]-N'-(2-methylpropyl)propanediamide
CID 108941583
methyl N-[2-[2-(3-methoxyphenyl)ethylamino]-2-oxoethyl]carbamate
CID 47308059
N-[2-(4-chlorophenyl)ethyl]-2-[2-(3-methoxyphenyl)ethylamino]acetamide
CID 109000854
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 109001073
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
3-[2-(3-methoxyphenyl)ethylamino]-N-(3-methylbutyl)propanamide
CID 109025637
2-bromo-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 107906044
2-chloro-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 103881563
2-[2-(3-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]acetamide
CID 108997173
N-[2-(3-methoxyphenyl)ethyl]-2-oxopropanamide
CID 110478240
4-[2-(3-methoxyphenyl)ethylamino]-4-oxobutanoic acid;hydrochloride
CID 170649983

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide?
The IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide (CID 108993195) is N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide.
What is the SMILES notation for N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide?
The canonical SMILES for N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide is COc1cccc(CCNC(=O)CNCC(C)C)c1.
What is the InChIKey of N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide?
The InChIKey is ILJHGEJXUXNJKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(2)10-16-11-15(18)17-8-7-13-5-4-6-14(9-13)19-3/h4-6,9,12,16H,7-8,10-11H2,1-3H3,(H,17,18).
What are the key properties of N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide?
N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.60, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide is sourced from PubChem (CID 108993195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).