2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide

C13H29N3O2 — CID 81061565

IUPAC2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide
SMILESCC(C)OCCN(C)CCCCC(C)(N)C(N)=O
InChIInChI=1S/C13H29N3O2/c1-11(2)18-10-9-16(4)8-6-5-7-13(3,15)12(14)17/h11H,5-10,15H2,1-4H3,(H2,14,17)
InChIKeyFQOJRKULFPTUPV-UHFFFAOYSA-N
MW259.39 g/mol
LogP0.72
Rot. Bonds10

About 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide

2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide (PubChem CID 81061565) has the molecular formula C13H29N3O2 and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide.

Molecular Properties

Compound Name2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide
PubChem CID81061565
Molecular FormulaC13H29N3O2
Molecular Weight259.39 g/mol
Exact Mass259.23
IUPAC Name2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide
SMILESCC(C)OCCN(C)CCCCC(C)(N)C(N)=O
InChIInChI=1S/C13H29N3O2/c1-11(2)18-10-9-16(4)8-6-5-7-13(3,15)12(14)17/h11H,5-10,15H2,1-4H3,(H2,14,17)
InChIKeyFQOJRKULFPTUPV-UHFFFAOYSA-N
XLogP0.72
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

methyl 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanoate
CID 81062130
ethyl 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanoate
CID 81073933
2-amino-6-[3-(dimethylamino)propyl-methylamino]-2-methylhexanamide
CID 55226399
methyl 2-amino-2-methyl-4-[methyl(2-propan-2-yloxyethyl)amino]butanoate
CID 81074648
2,2-dimethyl-4-[methyl(2-propan-2-yloxyethyl)amino]butanethioamide
CID 81055852
methyl 2-methyl-5-[methyl(2-propan-2-yloxyethyl)amino]-2-(propan-2-ylamino)pentanoate
CID 81062894
hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate
CID 81068250
2-hydroxy-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
CID 81056783
1-N,2-dimethyl-1-N-(2-propan-2-yloxyethyl)propane-1,2-diamine
CID 81055039
2-amino-2-methyl-5-(1,1,1-trifluoropropan-2-yloxy)pentanamide
CID 66274633
2,2-dimethyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanoic acid
CID 81057064
2-amino-3-[methyl(2-propan-2-yloxyethyl)amino]propanamide
CID 81062306

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide?
The IUPAC name of 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide (CID 81061565) is 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide.
What is the SMILES notation for 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide?
The canonical SMILES for 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide is CC(C)OCCN(C)CCCCC(C)(N)C(N)=O.
What is the InChIKey of 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide?
The InChIKey is FQOJRKULFPTUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O2/c1-11(2)18-10-9-16(4)8-6-5-7-13(3,15)12(14)17/h11H,5-10,15H2,1-4H3,(H2,14,17).
What are the key properties of 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide?
2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide has a molecular weight of 259.39 g/mol, XLogP of 0.72, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide is sourced from PubChem (CID 81061565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).