N,2-dimethyl-6-(methylamino)hexanamide

C9H20N2O — CID 153084375

IUPACN,2-dimethyl-6-(methylamino)hexanamide
SMILESCNCCCCC(C)C(=O)NC
InChIInChI=1S/C9H20N2O/c1-8(9(12)11-3)6-4-5-7-10-2/h8,10H,4-7H2,1-3H3,(H,11,12)
InChIKeyVNXGNQFSDXKAPS-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.76
Rot. Bonds6

About N,2-dimethyl-6-(methylamino)hexanamide

N,2-dimethyl-6-(methylamino)hexanamide (PubChem CID 153084375) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N,2-dimethyl-6-(methylamino)hexanamide.

Molecular Properties

Compound NameN,2-dimethyl-6-(methylamino)hexanamide
PubChem CID153084375
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN,2-dimethyl-6-(methylamino)hexanamide
SMILESCNCCCCC(C)C(=O)NC
InChIInChI=1S/C9H20N2O/c1-8(9(12)11-3)6-4-5-7-10-2/h8,10H,4-7H2,1-3H3,(H,11,12)
InChIKeyVNXGNQFSDXKAPS-UHFFFAOYSA-N
XLogP0.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-acetamido-N-methyl-6-(methylamino)hexanamide;ethane
CID 171511904
6-(methylamino)-2-(2-methylheptanoylamino)hexanoic acid
CID 118032738
(3R)-3,7-bis(methylamino)heptan-2-one
CID 91227284
6-(methylamino)-2-(methylcarbamoylamino)hexanoic acid
CID 20593439
N-[5-(ethylamino)-6-oxoheptyl]-2-methyl-6-(methylamino)hexanamide
CID 90364828
2-methyl-5-(methylamino)pentanoic acid
CID 59942755
tert-butyl N-[(2S)-1,6-bis(methylamino)-1-oxohexan-2-yl]carbamate
CID 11097723
5-(dimethylamino)-N,2-dimethylpentanamide
CID 123779216
2-methyl-8-(methylamino)-4-(propan-2-ylamino)octan-3-one
CID 139435461
N,2,5-trimethylhexanamide
CID 78065622
2-methyl-N-[4-(methylamino)butyl]propanamide
CID 134337431
(2S)-N-methyl-2,6-bis(2-oxohydrazinyl)hexanamide
CID 89114426

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-(methylamino)hexanamide?
The IUPAC name of N,2-dimethyl-6-(methylamino)hexanamide (CID 153084375) is N,2-dimethyl-6-(methylamino)hexanamide.
What is the SMILES notation for N,2-dimethyl-6-(methylamino)hexanamide?
The canonical SMILES for N,2-dimethyl-6-(methylamino)hexanamide is CNCCCCC(C)C(=O)NC.
What is the InChIKey of N,2-dimethyl-6-(methylamino)hexanamide?
The InChIKey is VNXGNQFSDXKAPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-8(9(12)11-3)6-4-5-7-10-2/h8,10H,4-7H2,1-3H3,(H,11,12).
What are the key properties of N,2-dimethyl-6-(methylamino)hexanamide?
N,2-dimethyl-6-(methylamino)hexanamide has a molecular weight of 172.27 g/mol, XLogP of 0.76, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-(methylamino)hexanamide is sourced from PubChem (CID 153084375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).