N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide

C13H27N3O — CID 119054103

IUPACN-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide
SMILESCCN(CC)CCN(C)C(=O)C1CCCCN1
InChIInChI=1S/C13H27N3O/c1-4-16(5-2)11-10-15(3)13(17)12-8-6-7-9-14-12/h12,14H,4-11H2,1-3H3
InChIKeyFBQHJGVAFGAVDZ-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.93
Rot. Bonds6

About N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide

N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide (PubChem CID 119054103) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide
PubChem CID119054103
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide
SMILESCCN(CC)CCN(C)C(=O)C1CCCCN1
InChIInChI=1S/C13H27N3O/c1-4-16(5-2)11-10-15(3)13(17)12-8-6-7-9-14-12/h12,14H,4-11H2,1-3H3
InChIKeyFBQHJGVAFGAVDZ-UHFFFAOYSA-N
XLogP0.93
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-methyl-N-propylpiperidine-2-carboxamide
CID 93272806
(2R)-N-[2-(dimethylamino)ethyl]-N-methylpyrrolidine-2-carboxamide
CID 89362128
(2S)-N-methyl-N-propylpyrrolidine-2-carboxamide
CID 54558702
N-[2-(diethylamino)-2-oxoethyl]-N-methylpiperidine-2-carboxamide
CID 54872870
N-(3-methoxypropyl)-N-methylpiperidine-2-carboxamide
CID 63008049
(2S)-N-methyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 95031613
(2R)-N-methyl-N-(2-methylsulfonylethyl)piperidine-2-carboxamide;hydrochloride
CID 119725318
(2R)-N-methyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide;hydrochloride
CID 119772557
(2R)-N-ethyl-N-propylpiperidine-2-carboxamide
CID 93272549
N-(cyclopropylmethyl)-N-methylazepane-2-carboxamide
CID 64563812
N-methyl-N-[2-(oxan-4-yl)ethyl]piperidine-2-carboxamide
CID 115159827
(2R)-N-(2,2-difluoroethyl)-N-methylpiperidine-2-carboxamide
CID 103809890

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide (CID 119054103) is N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide is CCN(CC)CCN(C)C(=O)C1CCCCN1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide?
The InChIKey is FBQHJGVAFGAVDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-4-16(5-2)11-10-15(3)13(17)12-8-6-7-9-14-12/h12,14H,4-11H2,1-3H3.
What are the key properties of N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide?
N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide has a molecular weight of 241.38 g/mol, XLogP of 0.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 119054103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).