2-ethyl-N,N-dimethylhexanamide

C10H21NO — CID 3019000

IUPAC2-ethyl-N,N-dimethylhexanamide
SMILESCCCCC(CC)C(=O)N(C)C
InChIInChI=1S/C10H21NO/c1-5-7-8-9(6-2)10(12)11(3)4/h9H,5-8H2,1-4H3
InChIKeyYVAKVTNKLMUNBR-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.29
Rot. Bonds5

About 2-ethyl-N,N-dimethylhexanamide

2-ethyl-N,N-dimethylhexanamide (PubChem CID 3019000) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-ethyl-N,N-dimethylhexanamide.

Molecular Properties

Compound Name2-ethyl-N,N-dimethylhexanamide
PubChem CID3019000
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-ethyl-N,N-dimethylhexanamide
SMILESCCCCC(CC)C(=O)N(C)C
InChIInChI=1S/C10H21NO/c1-5-7-8-9(6-2)10(12)11(3)4/h9H,5-8H2,1-4H3
InChIKeyYVAKVTNKLMUNBR-UHFFFAOYSA-N
XLogP2.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-ethyl-N,N-dimethylhexanamide 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-ethenyl-2-ethyl-N-methylhexanamide
CID 87457733
N-(2-chloroethyl)-2-ethyl-N-methylhexanamide
CID 63391803
(5Z,8Z,11Z,14Z)-2-ethyl-N,N-dimethylicosa-5,8,11,14-tetraenamide
CID 129209346
3-[2-ethylhexanoyl(methyl)amino]-2-methylpropanoic acid
CID 55007969
N-(2,2-dimethoxyethyl)-2-ethyl-N-methylhexanamide
CID 3414644
3,5-diethylnonan-4-one
CID 115785527
(2R)-2-amino-N,N-dimethylhexanamide
CID 87696829
2-(2-hydroxypropan-2-yl)-N,N-dimethylhexanamide
CID 23126581
cobalt;bis(2-ethylhexanoic acid)
CID 85390748
2-ethylhexanoic acid;niobium
CID 87060397
2-ethylhexanoic acid;palladium(2+)
CID 18629949
bis(2-ethylhexanoic acid);manganese(3+)
CID 175736722

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N-dimethylhexanamide?
The IUPAC name of 2-ethyl-N,N-dimethylhexanamide (CID 3019000) is 2-ethyl-N,N-dimethylhexanamide.
What is the SMILES notation for 2-ethyl-N,N-dimethylhexanamide?
The canonical SMILES for 2-ethyl-N,N-dimethylhexanamide is CCCCC(CC)C(=O)N(C)C.
What is the InChIKey of 2-ethyl-N,N-dimethylhexanamide?
The InChIKey is YVAKVTNKLMUNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-7-8-9(6-2)10(12)11(3)4/h9H,5-8H2,1-4H3.
What are the key properties of 2-ethyl-N,N-dimethylhexanamide?
2-ethyl-N,N-dimethylhexanamide has a molecular weight of 171.28 g/mol, XLogP of 2.29, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N-dimethylhexanamide is sourced from PubChem (CID 3019000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).