2-(2-azidoethylamino)-2-methyloctanamide

C11H23N5O — CID 66188674

IUPAC2-(2-azidoethylamino)-2-methyloctanamide
SMILESCCCCCCC(C)(NCCN=[N+]=[N-])C(N)=O
InChIInChI=1S/C11H23N5O/c1-3-4-5-6-7-11(2,10(12)17)14-8-9-15-16-13/h14H,3-9H2,1-2H3,(H2,12,17)
InChIKeyPGLSTFWTDVADBH-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.10
Rot. Bonds10

About 2-(2-azidoethylamino)-2-methyloctanamide

2-(2-azidoethylamino)-2-methyloctanamide (PubChem CID 66188674) has the molecular formula C11H23N5O and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-(2-azidoethylamino)-2-methyloctanamide.

Molecular Properties

Compound Name2-(2-azidoethylamino)-2-methyloctanamide
PubChem CID66188674
Molecular FormulaC11H23N5O
Molecular Weight241.34 g/mol
Exact Mass241.19
IUPAC Name2-(2-azidoethylamino)-2-methyloctanamide
SMILESCCCCCCC(C)(NCCN=[N+]=[N-])C(N)=O
InChIInChI=1S/C11H23N5O/c1-3-4-5-6-7-11(2,10(12)17)14-8-9-15-16-13/h14H,3-9H2,1-2H3,(H2,12,17)
InChIKeyPGLSTFWTDVADBH-UHFFFAOYSA-N
XLogP2.10
TPSA103.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-(3-azidopropylamino)-2-methyloctanoic acid
CID 66191282
2-methyl-2-(methylamino)heptanamide
CID 80557436
2-methyl-6-(methylamino)-2-(propylamino)heptanediamide
CID 66221079
methyl 2-methyl-2-(propylamino)octanoate
CID 60796900
2-(2-azidoethylamino)-2-propylpentanoic acid
CID 66190985
2-(3-azidopropylamino)-3-(4-fluorophenyl)-2-methylpropanamide
CID 114832222
2-(3-azidopropylamino)-2-methylheptanenitrile
CID 80557277
2,2-dimethylhexadecanamide
CID 23297438
2,2-dimethyldecanamide
CID 22596903
sodium 2-(dodecylamino)-2-methylhexadecanoate
CID 88793434
2-methyl-2-(propylamino)-6-(1,1,1-trifluoropropan-2-yloxy)hexanamide
CID 66275068
6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide
CID 63008631

Frequently Asked Questions

What is the IUPAC name of 2-(2-azidoethylamino)-2-methyloctanamide?
The IUPAC name of 2-(2-azidoethylamino)-2-methyloctanamide (CID 66188674) is 2-(2-azidoethylamino)-2-methyloctanamide.
What is the SMILES notation for 2-(2-azidoethylamino)-2-methyloctanamide?
The canonical SMILES for 2-(2-azidoethylamino)-2-methyloctanamide is CCCCCCC(C)(NCCN=[N+]=[N-])C(N)=O.
What is the InChIKey of 2-(2-azidoethylamino)-2-methyloctanamide?
The InChIKey is PGLSTFWTDVADBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5O/c1-3-4-5-6-7-11(2,10(12)17)14-8-9-15-16-13/h14H,3-9H2,1-2H3,(H2,12,17).
What are the key properties of 2-(2-azidoethylamino)-2-methyloctanamide?
2-(2-azidoethylamino)-2-methyloctanamide has a molecular weight of 241.34 g/mol, XLogP of 2.10, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-azidoethylamino)-2-methyloctanamide is sourced from PubChem (CID 66188674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).