2-(dimethylamino)-N-methylhexanamide

C9H20N2O — CID 126638644

IUPAC2-(dimethylamino)-N-methylhexanamide
SMILESCCCCC(C(=O)NC)N(C)C
InChIInChI=1S/C9H20N2O/c1-5-6-7-8(11(3)4)9(12)10-2/h8H,5-7H2,1-4H3,(H,10,12)
InChIKeyDWEGHMSGSRRYBK-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.85
Rot. Bonds5

About 2-(dimethylamino)-N-methylhexanamide

2-(dimethylamino)-N-methylhexanamide (PubChem CID 126638644) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(dimethylamino)-N-methylhexanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-methylhexanamide
PubChem CID126638644
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-(dimethylamino)-N-methylhexanamide
SMILESCCCCC(C(=O)NC)N(C)C
InChIInChI=1S/C9H20N2O/c1-5-6-7-8(11(3)4)9(12)10-2/h8H,5-7H2,1-4H3,(H,10,12)
InChIKeyDWEGHMSGSRRYBK-UHFFFAOYSA-N
XLogP0.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-[methyl((113C)methyl)(15N)amino](5,6-13C2)hexanoylamino]propanoic acid
CID 162702216
6-acetamido-2-(dimethylamino)-N-(113C)methylhexan(15N)amide;acetic acid
CID 157202614
acetic acid;6-(acetylamino)-2-(dimethylamino)-N-(113C)methylhexan(15N)amide
CID 157202604
(2S)-2-amino-N-methylhexanamide;hydrochloride
CID 141190381
2-(dimethylamino)tetracosanoic acid
CID 19101458
2-(dimethylamino)tetradecanoic acid;hydroiodide
CID 122684236
2-(dimethylamino)pentadecanoic acid;hydrochloride
CID 87499144
2-(dimethylamino)hexacosanoic acid;hydrobromide
CID 173436774
methyl 2-[methyl-[2-(methylamino)-2-oxoethyl]amino]hexanoate
CID 115868845
2-chloro-N-methylheptanamide
CID 62224207
2-(dimethylamino)hexadecanoic acid;methoxymethane
CID 175149537
2-[2-carboxyethyl(methyl)amino]hexanoic acid
CID 82328730

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-methylhexanamide?
The IUPAC name of 2-(dimethylamino)-N-methylhexanamide (CID 126638644) is 2-(dimethylamino)-N-methylhexanamide.
What is the SMILES notation for 2-(dimethylamino)-N-methylhexanamide?
The canonical SMILES for 2-(dimethylamino)-N-methylhexanamide is CCCCC(C(=O)NC)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-methylhexanamide?
The InChIKey is DWEGHMSGSRRYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-5-6-7-8(11(3)4)9(12)10-2/h8H,5-7H2,1-4H3,(H,10,12).
What are the key properties of 2-(dimethylamino)-N-methylhexanamide?
2-(dimethylamino)-N-methylhexanamide has a molecular weight of 172.27 g/mol, XLogP of 0.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-methylhexanamide is sourced from PubChem (CID 126638644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).