N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen

C11H26N2O3 — CID 177167063

IUPACN-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen
SMILESCCNC(=O)CONC(=O)CCC(C)CC.[H][H].[H][H]
InChIInChI=1S/C11H22N2O3.2H2/c1-4-9(3)6-7-10(14)13-16-8-11(15)12-5-2;;/h9H,4-8H2,1-3H3,(H,12,15)(H,13,14);2*1H
InChIKeyBRIGLRSXGRIKRA-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.49
Rot. Bonds8

About N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen

N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen (PubChem CID 177167063) has the molecular formula C11H26N2O3 and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen.

Molecular Properties

Compound NameN-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen
PubChem CID177167063
Molecular FormulaC11H26N2O3
Molecular Weight234.34 g/mol
Exact Mass234.19
IUPAC NameN-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen
SMILESCCNC(=O)CONC(=O)CCC(C)CC.[H][H].[H][H]
InChIInChI=1S/C11H22N2O3.2H2/c1-4-9(3)6-7-10(14)13-16-8-11(15)12-5-2;;/h9H,4-8H2,1-3H3,(H,12,15)(H,13,14);2*1H
InChIKeyBRIGLRSXGRIKRA-UHFFFAOYSA-N
XLogP1.49
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(hydroxymethyl)-4-methylhexanamide
CID 88779870
N-[2-(4-methylpentylamino)-2-oxoethoxy]-3-(propan-2-ylamino)propanamide
CID 176814500
tert-butyl N-[2-(ethylamino)-2-oxoethoxy]carbamate
CID 88940321
3-methylpentyl 2-methylbutanoate
CID 3019319
N-ethyl-2-[2-(ethylamino)-2-oxoethoxy]acetamide
CID 13126647
ethyl (2R)-2-amino-5-(ethylamino)-5-oxopentanoate
CID 71815737
N-butyl-2-[2-[2-(4-methylhexoxy)ethoxy]ethoxy]acetamide;molecular hydrogen;sulfane
CID 171540633
4-methyl-N-tridecylhexanamide
CID 89162842
bis(3-methylpentyl) pentanedioate
CID 91706840
N-[2-(3-methylpentoxy)ethyl]-5-propan-2-yloxypentanamide;molecular hydrogen
CID 177338040
propan-2-yl 3-[[[2-[2-[2-(3-methylpentoxy)ethoxy]ethoxy]acetyl]amino]methoxy]propanoate
CID 167448183
6-amino-N-ethoxy-4-ethylhexanamide
CID 64974724

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen?
The IUPAC name of N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen (CID 177167063) is N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen.
What is the SMILES notation for N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen?
The canonical SMILES for N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen is CCNC(=O)CONC(=O)CCC(C)CC.[H][H].[H][H].
What is the InChIKey of N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen?
The InChIKey is BRIGLRSXGRIKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3.2H2/c1-4-9(3)6-7-10(14)13-16-8-11(15)12-5-2;;/h9H,4-8H2,1-3H3,(H,12,15)(H,13,14);2*1H.
What are the key properties of N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen?
N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen has a molecular weight of 234.34 g/mol, XLogP of 1.49, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)-2-oxoethoxy]-4-methylhexanamide;molecular hydrogen is sourced from PubChem (CID 177167063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).