6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide

C13H28N2O2 — CID 79379037

IUPAC6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide
SMILESCCC(CCN)CCC(=O)N(C)CC(C)(C)O
InChIInChI=1S/C13H28N2O2/c1-5-11(8-9-14)6-7-12(16)15(4)10-13(2,3)17/h11,17H,5-10,14H2,1-4H3
InChIKeySTXBHABYYYHYNJ-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.37
Rot. Bonds8

About 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide

6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide (PubChem CID 79379037) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide.

Molecular Properties

Compound Name6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide
PubChem CID79379037
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide
SMILESCCC(CCN)CCC(=O)N(C)CC(C)(C)O
InChIInChI=1S/C13H28N2O2/c1-5-11(8-9-14)6-7-12(16)15(4)10-13(2,3)17/h11,17H,5-10,14H2,1-4H3
InChIKeySTXBHABYYYHYNJ-UHFFFAOYSA-N
XLogP1.37
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-4-ethyl-N-methyl-N-(2-methylsulfanylethyl)hexanamide
CID 112658971
6-amino-N-(2-ethoxyethyl)-4-ethyl-N-methylhexanamide
CID 81059329
6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide
CID 114243064
2-amino-N-(2-hydroxy-2-methylpropyl)-N-methylbutanamide
CID 79377752
8-amino-6-ethyloctan-3-one
CID 116578085
6-amino-4-ethyl-2-methylhexan-2-ol
CID 146359266
6-amino-4-ethyl-N-(2-hydroxy-2-methylbutyl)hexanamide
CID 65106452
6-amino-N-ethoxy-4-ethylhexanamide
CID 64974724
2-carbamothioyl-N-(2-hydroxy-2-methylpropyl)-N-methylbutanamide
CID 79378078
2-[(6-amino-4-ethylhexanoyl)-prop-2-ynylamino]acetic acid
CID 79272924
6-amino-1-cyclopropyl-4-ethylhexan-1-one
CID 116578317
3-[(6-amino-4-ethylhexanoyl)amino]-2-methylbutanoic acid
CID 113416432

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide?
The IUPAC name of 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide (CID 79379037) is 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide.
What is the SMILES notation for 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide?
The canonical SMILES for 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide is CCC(CCN)CCC(=O)N(C)CC(C)(C)O.
What is the InChIKey of 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide?
The InChIKey is STXBHABYYYHYNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-5-11(8-9-14)6-7-12(16)15(4)10-13(2,3)17/h11,17H,5-10,14H2,1-4H3.
What are the key properties of 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide?
6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide has a molecular weight of 244.38 g/mol, XLogP of 1.37, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide is sourced from PubChem (CID 79379037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).