ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide

C18H38N2O3 — CID 142391107

IUPACethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide
SMILESCC.CNC(=O)CCCCOCCCOCCN1CCCCC1
InChIInChI=1S/C16H32N2O3.C2H6/c1-17-16(19)8-3-6-12-20-13-7-14-21-15-11-18-9-4-2-5-10-18;1-2/h2-15H2,1H3,(H,17,19);1-2H3
InChIKeyQOTPCBOLQCTHMD-UHFFFAOYSA-N
MW330.51 g/mol
LogP2.84
Rot. Bonds12

About ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide

ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide (PubChem CID 142391107) has the molecular formula C18H38N2O3 and a molecular weight of 330.51 g/mol. Its IUPAC name is ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide.

Molecular Properties

Compound Nameethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide
PubChem CID142391107
Molecular FormulaC18H38N2O3
Molecular Weight330.51 g/mol
Exact Mass330.29
IUPAC Nameethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide
SMILESCC.CNC(=O)CCCCOCCCOCCN1CCCCC1
InChIInChI=1S/C16H32N2O3.C2H6/c1-17-16(19)8-3-6-12-20-13-7-14-21-15-11-18-9-4-2-5-10-18;1-2/h2-15H2,1H3,(H,17,19);1-2H3
InChIKeyQOTPCBOLQCTHMD-UHFFFAOYSA-N
XLogP2.84
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.51
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-(4-methoxybutoxy)-N-methylhexanamide;3-[4-(2-methoxyethoxy)butoxy]-N-methylpropanamide;5-[2-(2-methoxyethoxy)ethoxy]-N-methylpentanamide;8-(2-methoxyethoxy)-N-methyloctanamide;2-[5-(2-methoxyethoxy)pentoxy]-N-methylacetamide;4-[3-(2-methoxyethoxy)propoxy]-N-methylbutanamide;5-(5-methoxypentoxy)-N-methylpentanamide;7-(3-methoxypropoxy)-N-methylheptanamide;N-methyl-2-[4-(4-methylpiperazin-1-yl)butoxy]acetamide;N-methyl-2-[2-(4-methylpiperazin-1-yl)ethoxy]acetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethoxy]butoxy]acetamide;N-methyl-2-[2-[2-(4-methylpiperazin-1-yl)ethoxy]ethoxy]acetamide;N-methyl-2-[3-[2-(4-methylpiperazin-1-yl)ethoxy]propoxy]acetamide;N-methyl-2-[5-(4-methylpiperazin-1-yl)pentoxy]acetamide;N-methyl-2-[3-(4-methylpiperazin-1-yl)propoxy]acetamide
CID 158097425
N-methyl-3-pyrrolidin-1-ylpropanamide
CID 20700879
ethane;1-[2-(4-methoxybutoxy)ethyl]piperidine
CID 142390245
2-[5-(2-piperidin-1-ylethoxy)pentoxy]acetamide
CID 142368425
ethane;1-(5-ethoxypentyl)piperidine;N-methylformamide
CID 142367464
1-[2-[3-(2-ethoxyethoxy)propoxy]ethyl]piperidine;N-methylformamide
CID 171081654
1,4-bis(3-methoxypropyl)piperazine;1-[2-(4-methoxybutoxy)ethyl]-4-methylpiperazine;2-(4-methoxybutoxy)-N-methylacetamide;1-(4-methoxybutyl)-4-(2-methoxyethyl)piperazine;2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N-methylacetamide;2-[2-(2-methoxyethoxy)ethoxy]-N-methylacetamide;2-(2-methoxyethoxy)-N-methylacetamide;4-(2-methoxyethoxy)-N-methylbutanamide;5-(2-methoxyethoxy)-N-methylpentanamide;3-(2-methoxyethoxy)-N-methylpropanamide;1-(7-methoxyheptyl)-4-methylpiperazine;methoxymethane;2-methoxy-N-methylacetamide;4-methoxy-N-methylbutanamide;7-methoxy-N-methylheptanamide;6-methoxy-N-methylhexanamide;5-methoxy-N-methylpentanamide;3-methoxy-N-methylpropanamide;2-(3-methoxypropoxy)-N-methylacetamide;4-(3-methoxypropoxy)-N-methylbutanamide;3-(3-methoxypropoxy)-N-methylpropanamide;1-methyl-4-[4-(4-methylpiperazin-1-yl)butyl]piperazine
CID 159751456
N-methyl-3-(2-piperidin-1-ylethoxy)propan-1-amine
CID 62459312
1-[2-(3-methoxypropoxy)ethyl]piperidine
CID 134364578
ethane;N-methyl-7-morpholin-4-ylheptanamide
CID 176680362
N-methyl-3-[2-(4-piperidin-1-ylbutoxy)phenyl]propanamide
CID 20719073
N-methyl-7-morpholin-4-ylheptanamide
CID 176680363

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide?
The IUPAC name of ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide (CID 142391107) is ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide.
What is the SMILES notation for ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide?
The canonical SMILES for ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide is CC.CNC(=O)CCCCOCCCOCCN1CCCCC1.
What is the InChIKey of ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide?
The InChIKey is QOTPCBOLQCTHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O3.C2H6/c1-17-16(19)8-3-6-12-20-13-7-14-21-15-11-18-9-4-2-5-10-18;1-2/h2-15H2,1H3,(H,17,19);1-2H3.
What are the key properties of ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide?
ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide has a molecular weight of 330.51 g/mol, XLogP of 2.84, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-5-[3-(2-piperidin-1-ylethoxy)propoxy]pentanamide is sourced from PubChem (CID 142391107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).