N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide

C12H21N3O2 — CID 43579066

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide
SMILESCN(CC(=O)NC1CC1)C(=O)C1CCCNC1
InChIInChI=1S/C12H21N3O2/c1-15(8-11(16)14-10-4-5-10)12(17)9-3-2-6-13-7-9/h9-10,13H,2-8H2,1H3,(H,14,16)
InChIKeyALIVVATVEQOXDN-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.28
Rot. Bonds4

About N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide

N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide (PubChem CID 43579066) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide
PubChem CID43579066
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide
SMILESCN(CC(=O)NC1CC1)C(=O)C1CCCNC1
InChIInChI=1S/C12H21N3O2/c1-15(8-11(16)14-10-4-5-10)12(17)9-3-2-6-13-7-9/h9-10,13H,2-8H2,1H3,(H,14,16)
InChIKeyALIVVATVEQOXDN-UHFFFAOYSA-N
XLogP-0.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-4-carboxamide
CID 43579064
N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
CID 54868907
N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]piperidine-3-carboxamide
CID 119291399
N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
CID 50988968
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
N-cyclohexyl-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63644075
N-(4-methylcyclohexyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55249118
(3S)-N-methyl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 81124814
N-(3,3-dimethylbutyl)-N-methylpiperidine-3-carboxamide
CID 115159936
N-(2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119299426
(3S)-N-methyl-N-[3-(methylamino)propyl]piperidine-3-carboxamide
CID 81134967
N-[2-(3,4-dichloroanilino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119267757

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide (CID 43579066) is N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide is CN(CC(=O)NC1CC1)C(=O)C1CCCNC1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide?
The InChIKey is ALIVVATVEQOXDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-15(8-11(16)14-10-4-5-10)12(17)9-3-2-6-13-7-9/h9-10,13H,2-8H2,1H3,(H,14,16).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide has a molecular weight of 239.32 g/mol, XLogP of -0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 43579066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).