6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide

C12H27N3O — CID 61249637

IUPAC6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide
SMILESCN(C)C(C)(C)CNC(=O)CCCCCN
InChIInChI=1S/C12H27N3O/c1-12(2,15(3)4)10-14-11(16)8-6-5-7-9-13/h5-10,13H2,1-4H3,(H,14,16)
InChIKeySVIPNBMKGUYFGE-UHFFFAOYSA-N
MW229.37 g/mol
LogP0.96
Rot. Bonds8

About 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide

6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide (PubChem CID 61249637) has the molecular formula C12H27N3O and a molecular weight of 229.37 g/mol. Its IUPAC name is 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide
PubChem CID61249637
Molecular FormulaC12H27N3O
Molecular Weight229.37 g/mol
Exact Mass229.22
IUPAC Name6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide
SMILESCN(C)C(C)(C)CNC(=O)CCCCCN
InChIInChI=1S/C12H27N3O/c1-12(2,15(3)4)10-14-11(16)8-6-5-7-9-13/h5-10,13H2,1-4H3,(H,14,16)
InChIKeySVIPNBMKGUYFGE-UHFFFAOYSA-N
XLogP0.96
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-amino-N-(2-hydroxy-2-methylpropyl)hexanamide
CID 65106883
6-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]hexanamide
CID 24697839
7-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]heptanamide
CID 24701938
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
CID 106148441
7-amino-N-(2-methyl-2-methylsulfonylpropyl)heptanamide
CID 79550577
5-amino-N-(3-hydroxy-2,2-dimethylpropyl)pentanamide
CID 115360270
5-amino-N-(2-methyl-2-methylsulfonylpropyl)pentanamide
CID 79550040
7-amino-N-(2,2,4-trimethylpentyl)heptanamide;hydrochloride
CID 119820235
3-(5-aminopentanoylamino)-N,2,2-trimethylpropanamide
CID 106276822
5-amino-N-(4-hydroxy-2,2-dimethylbutyl)pentanamide
CID 106147943
6-amino-N-[2-(methanesulfonamido)-2-methylpropyl]hexanamide
CID 63865751
7-amino-N-(3-amino-2,2-difluoropropyl)heptanamide
CID 122081032

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide?
The IUPAC name of 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide (CID 61249637) is 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide.
What is the SMILES notation for 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide?
The canonical SMILES for 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide is CN(C)C(C)(C)CNC(=O)CCCCCN.
What is the InChIKey of 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide?
The InChIKey is SVIPNBMKGUYFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O/c1-12(2,15(3)4)10-14-11(16)8-6-5-7-9-13/h5-10,13H2,1-4H3,(H,14,16).
What are the key properties of 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide?
6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide has a molecular weight of 229.37 g/mol, XLogP of 0.96, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide is sourced from PubChem (CID 61249637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).