N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide

C16H32N2O3 — CID 15787992

IUPACN-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide
SMILESCCCCCCNC(=O)COCC(=O)NCCCCCC
InChIInChI=1S/C16H32N2O3/c1-3-5-7-9-11-17-15(19)13-21-14-16(20)18-12-10-8-6-4-2/h3-14H2,1-2H3,(H,17,19)(H,18,20)
InChIKeySSMUIAPAVGHGIM-UHFFFAOYSA-N
MW300.44 g/mol
LogP2.40
Rot. Bonds14

About N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide

N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide (PubChem CID 15787992) has the molecular formula C16H32N2O3 and a molecular weight of 300.44 g/mol. Its IUPAC name is N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide.

Molecular Properties

Compound NameN-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide
PubChem CID15787992
Molecular FormulaC16H32N2O3
Molecular Weight300.44 g/mol
Exact Mass300.24
IUPAC NameN-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide
SMILESCCCCCCNC(=O)COCC(=O)NCCCCCC
InChIInChI=1S/C16H32N2O3/c1-3-5-7-9-11-17-15(19)13-21-14-16(20)18-12-10-8-6-4-2/h3-14H2,1-2H3,(H,17,19)(H,18,20)
InChIKeySSMUIAPAVGHGIM-UHFFFAOYSA-N
XLogP2.40
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.44
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Acetamide, 2-butoxy-N-cyclohexyl-
CID 94879
Acetic acid pentadecylcarbamoylmethyl ester
CID 11088732
N-[3-(4-aminobutylamino)propyl]-2-methoxyacetamide;hydrochloride
CID 118721810
N-[4-(3-aminopropylamino)butyl]-2-methoxyacetamide;hydrochloride
CID 118721813
N-(4-aminocyclohexyl)-2-methoxyacetamide
CID 61279804
Acetamide, 2,2'-(ethylenedioxy)bis[n-dodecyl-
CID 618089
Calcium ionophore V
CID 4614858
N,N'-dimethyl-N,N'-dihexyl-3-oxapentanediamide
CID 15787990
N-cyclohexyl-2-methoxyacetamide
CID 16753097
N,N-dioctyldiglycolamide
CID 54763310
N-hexyl-2-methoxyacetamide
CID 60671004
N,N,N',N'-tetra-n-hexyl-3-oxa-pentanediamide
CID 85786941

Frequently Asked Questions

What is the IUPAC name of N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide?
The IUPAC name of N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide (CID 15787992) is N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide.
What is the SMILES notation for N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide?
The canonical SMILES for N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide is CCCCCCNC(=O)COCC(=O)NCCCCCC.
What is the InChIKey of N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide?
The InChIKey is SSMUIAPAVGHGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O3/c1-3-5-7-9-11-17-15(19)13-21-14-16(20)18-12-10-8-6-4-2/h3-14H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide?
N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide has a molecular weight of 300.44 g/mol, XLogP of 2.40, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-2-[2-(hexylamino)-2-oxoethoxy]acetamide is sourced from PubChem (CID 15787992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).