N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide

C15H31N3O2 — CID 63129598

IUPACN-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCCN(C)CCOC)CCNCC1
InChIInChI=1S/C15H31N3O2/c1-4-5-15(6-8-16-9-7-15)14(19)17-10-11-18(2)12-13-20-3/h16H,4-13H2,1-3H3,(H,17,19)
InChIKeyGHRYBCSQQXMCPS-UHFFFAOYSA-N
MW285.43 g/mol
LogP0.85
Rot. Bonds9

About N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide

N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide (PubChem CID 63129598) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
PubChem CID63129598
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCCN(C)CCOC)CCNCC1
InChIInChI=1S/C15H31N3O2/c1-4-5-15(6-8-16-9-7-15)14(19)17-10-11-18(2)12-13-20-3/h16H,4-13H2,1-3H3,(H,17,19)
InChIKeyGHRYBCSQQXMCPS-UHFFFAOYSA-N
XLogP0.85
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[ethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
CID 55176449
N-(2-aminoethyl)-4-propylpiperidine-4-carboxamide
CID 63128598
2-ethyl-N-[2-[2-methoxyethyl(methyl)amino]ethyl]pyrrolidine-2-carboxamide
CID 83072304
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-3-methylpiperidine-3-carboxamide;dihydrochloride
CID 119946941
N-(cyanomethyl)-4-propylpiperidine-4-carboxamide
CID 63129150
N-(2-methylsulfonylethyl)-4-propylpiperidine-4-carboxamide
CID 55177593
N-[2-(dimethylamino)-3-methylbutyl]-4-propylpiperidine-4-carboxamide
CID 63128641
N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide
CID 63129005
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-propylpiperidine-4-carboxamide
CID 83112493
N-[2-oxo-2-(propylamino)ethyl]-4-propylpiperidine-4-carboxamide
CID 63127591
4-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]oxane-4-carboxamide
CID 113280761
N-[3-(diethylamino)propyl]-3-propylpyrrolidine-3-carboxamide
CID 63138470

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide (CID 63129598) is N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)NCCN(C)CCOC)CCNCC1.
What is the InChIKey of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide?
The InChIKey is GHRYBCSQQXMCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-4-5-15(6-8-16-9-7-15)14(19)17-10-11-18(2)12-13-20-3/h16H,4-13H2,1-3H3,(H,17,19).
What are the key properties of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide?
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide has a molecular weight of 285.43 g/mol, XLogP of 0.85, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 63129598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).