N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide

C16H26N2O2 — CID 102975694

IUPACN-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide
SMILESCCNC(=O)Cc1ccc(NCCC(C)(C)OC)cc1
InChIInChI=1S/C16H26N2O2/c1-5-17-15(19)12-13-6-8-14(9-7-13)18-11-10-16(2,3)20-4/h6-9,18H,5,10-12H2,1-4H3,(H,17,19)
InChIKeyFRLUZULWLPSOAV-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.59
Rot. Bonds8

About N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide

N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide (PubChem CID 102975694) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide
PubChem CID102975694
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide
SMILESCCNC(=O)Cc1ccc(NCCC(C)(C)OC)cc1
InChIInChI=1S/C16H26N2O2/c1-5-17-15(19)12-13-6-8-14(9-7-13)18-11-10-16(2,3)20-4/h6-9,18H,5,10-12H2,1-4H3,(H,17,19)
InChIKeyFRLUZULWLPSOAV-UHFFFAOYSA-N
XLogP2.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[4-(3-methylbutylamino)phenyl]acetamide
CID 43737544
N-ethyl-2-[4-(octylamino)phenyl]acetamide
CID 43737514
4-butyl-N-(3-methoxy-3-methylbutyl)aniline
CID 103033140
4-[(3-methoxy-3-methylbutyl)amino]-N-propan-2-ylbenzamide
CID 102975760
N-ethyl-2-[4-(prop-2-ynylamino)phenyl]acetamide
CID 63952885
N-ethyl-2-[4-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]acetamide
CID 115950017
2-[4-[(4-cyano-2,2-dimethylbutyl)amino]phenyl]-N-ethylacetamide
CID 115743112
1-N-(3-methoxy-3-methylbutyl)-4-N,4-N-dimethylbenzene-1,4-diamine
CID 103033160
2-[4-[2-(2,2-dimethylpropylamino)-2-oxoethyl]phenyl]-N-ethylacetamide;ethane;propane
CID 170603085
ethyl N-[4-[2-(ethylamino)-2-oxoethyl]phenyl]carbamate
CID 60747824
N-ethyl-2-[4-(methanesulfonamido)phenyl]acetamide
CID 60747826
3-[(3-methoxy-3-methylbutyl)amino]benzoic acid
CID 106675116

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide?
The IUPAC name of N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide (CID 102975694) is N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide.
What is the SMILES notation for N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide?
The canonical SMILES for N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide is CCNC(=O)Cc1ccc(NCCC(C)(C)OC)cc1.
What is the InChIKey of N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide?
The InChIKey is FRLUZULWLPSOAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-5-17-15(19)12-13-6-8-14(9-7-13)18-11-10-16(2,3)20-4/h6-9,18H,5,10-12H2,1-4H3,(H,17,19).
What are the key properties of N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide?
N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide has a molecular weight of 278.40 g/mol, XLogP of 2.59, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-[(3-methoxy-3-methylbutyl)amino]phenyl]acetamide is sourced from PubChem (CID 102975694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).