2-(methylamino)-N-(8-methylnonyl)acetamide

C13H28N2O — CID 170791103

IUPAC2-(methylamino)-N-(8-methylnonyl)acetamide
SMILESCNCC(=O)NCCCCCCCC(C)C
InChIInChI=1S/C13H28N2O/c1-12(2)9-7-5-4-6-8-10-15-13(16)11-14-3/h12,14H,4-11H2,1-3H3,(H,15,16)
InChIKeyGQJKSCZYTFLKOG-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.32
Rot. Bonds10

About 2-(methylamino)-N-(8-methylnonyl)acetamide

2-(methylamino)-N-(8-methylnonyl)acetamide (PubChem CID 170791103) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 2-(methylamino)-N-(8-methylnonyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(8-methylnonyl)acetamide
PubChem CID170791103
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name2-(methylamino)-N-(8-methylnonyl)acetamide
SMILESCNCC(=O)NCCCCCCCC(C)C
InChIInChI=1S/C13H28N2O/c1-12(2)9-7-5-4-6-8-10-15-13(16)11-14-3/h12,14H,4-11H2,1-3H3,(H,15,16)
InChIKeyGQJKSCZYTFLKOG-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.32
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-(methylamino)-N-[4-[[2-(methylamino)acetyl]amino]butyl]acetamide
CID 177413313
4-methyl-N-(6-methylheptyl)pentanamide
CID 129055781
N-(8-methylnonyl)-2-(2-methylpropylamino)acetamide
CID 156546991
2-hydroxy-N-(7-methyloctyl)acetamide
CID 134467211
3-hydroxy-N-[2-(5-methylhexylamino)-2-oxoethyl]propanamide
CID 176567984
N-(7-methyloctyl)-3-sulfanylpropanamide
CID 107818548
N-(4-hydroxybutyl)-2-(methylamino)acetamide
CID 106841932
2-methyl-N-(6-methylheptyl)propanamide
CID 139441078
2-(5-methylhexylamino)-N-propylacetamide
CID 115325791
N-hexyl-6-methylheptanamide
CID 141197249
1-methyl-3-(7-methyloctyl)urea
CID 71899901
4-methyl-N-[3-[[3-[[3-[5-[3-[3-[3-(4-methylpentanoylamino)propanoylamino]propanoylamino]propanoylamino]pentylamino]-3-oxopropyl]amino]-3-oxopropyl]amino]-3-oxopropyl]pentanamide
CID 59046039

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(8-methylnonyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(8-methylnonyl)acetamide (CID 170791103) is 2-(methylamino)-N-(8-methylnonyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(8-methylnonyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(8-methylnonyl)acetamide is CNCC(=O)NCCCCCCCC(C)C.
What is the InChIKey of 2-(methylamino)-N-(8-methylnonyl)acetamide?
The InChIKey is GQJKSCZYTFLKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-12(2)9-7-5-4-6-8-10-15-13(16)11-14-3/h12,14H,4-11H2,1-3H3,(H,15,16).
What are the key properties of 2-(methylamino)-N-(8-methylnonyl)acetamide?
2-(methylamino)-N-(8-methylnonyl)acetamide has a molecular weight of 228.38 g/mol, XLogP of 2.32, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(8-methylnonyl)acetamide is sourced from PubChem (CID 170791103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).