N-ethyl-5,5-dimethylhexanamide

C10H21NO — CID 121264886

IUPACN-ethyl-5,5-dimethylhexanamide
SMILESCCNC(=O)CCCC(C)(C)C
InChIInChI=1S/C10H21NO/c1-5-11-9(12)7-6-8-10(2,3)4/h5-8H2,1-4H3,(H,11,12)
InChIKeyKWEZUCQDYDLBMI-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.34
Rot. Bonds4

About N-ethyl-5,5-dimethylhexanamide

N-ethyl-5,5-dimethylhexanamide (PubChem CID 121264886) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-ethyl-5,5-dimethylhexanamide.

Molecular Properties

Compound NameN-ethyl-5,5-dimethylhexanamide
PubChem CID121264886
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-ethyl-5,5-dimethylhexanamide
SMILESCCNC(=O)CCCC(C)(C)C
InChIInChI=1S/C10H21NO/c1-5-11-9(12)7-6-8-10(2,3)4/h5-8H2,1-4H3,(H,11,12)
InChIKeyKWEZUCQDYDLBMI-UHFFFAOYSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(ethylamino)ethyl]-5,5-dimethylhexanamide;hydrochloride
CID 119509534
N,N'-diethylnonanediamide
CID 89048639
N-(5,5-dimethylhexyl)-6,6-dimethylheptanamide
CID 155613162
N-butyl-10,10-dimethylundecanamide
CID 19922141
ethane;N-(3-hydroxypropyl)-5,5-dimethylhexanamide;molecular hydrogen
CID 166490079
N-decyl-7,7-dimethyloctanamide
CID 139961894
N-ethyltridecanamide
CID 23297417
N-ethylhexadecanamide
CID 18377756
N-(5,5-dimethylhexyl)-4,4-dimethylpentanamide
CID 59197749
tert-butyl 5-(ethylamino)-5-oxopentanoate
CID 145414661
20-(ethylamino)-20-oxoicosanoic acid
CID 59533791
N'-ethylnonanediamide
CID 18377762

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5,5-dimethylhexanamide?
The IUPAC name of N-ethyl-5,5-dimethylhexanamide (CID 121264886) is N-ethyl-5,5-dimethylhexanamide.
What is the SMILES notation for N-ethyl-5,5-dimethylhexanamide?
The canonical SMILES for N-ethyl-5,5-dimethylhexanamide is CCNC(=O)CCCC(C)(C)C.
What is the InChIKey of N-ethyl-5,5-dimethylhexanamide?
The InChIKey is KWEZUCQDYDLBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-11-9(12)7-6-8-10(2,3)4/h5-8H2,1-4H3,(H,11,12).
What are the key properties of N-ethyl-5,5-dimethylhexanamide?
N-ethyl-5,5-dimethylhexanamide has a molecular weight of 171.28 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5,5-dimethylhexanamide is sourced from PubChem (CID 121264886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).