N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide

C12H23N3O2 — CID 54868907

IUPACN-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
SMILESCCCNC(=O)CN(C)C(=O)C1CCCNC1
InChIInChI=1S/C12H23N3O2/c1-3-6-14-11(16)9-15(2)12(17)10-5-4-7-13-8-10/h10,13H,3-9H2,1-2H3,(H,14,16)
InChIKeyBUANMAXBKCQCAK-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.03
Rot. Bonds5

About N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide

N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide (PubChem CID 54868907) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
PubChem CID54868907
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
SMILESCCCNC(=O)CN(C)C(=O)C1CCCNC1
InChIInChI=1S/C12H23N3O2/c1-3-6-14-11(16)9-15(2)12(17)10-5-4-7-13-8-10/h10,13H,3-9H2,1-2H3,(H,14,16)
InChIKeyBUANMAXBKCQCAK-UHFFFAOYSA-N
XLogP-0.03
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-oxo-2-(propylamino)ethyl]-N-propylpiperidine-3-carboxamide;hydrochloride
CID 119299137
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-3-carboxamide
CID 43579066
N-methyl-6-oxo-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
CID 112728459
(3S)-N-methyl-N-pentylpiperidine-3-carboxamide
CID 81123765
N,4-dimethyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-3-carboxamide
CID 55230155
N,3-dimethyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide
CID 102778464
N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]piperidine-3-carboxamide
CID 119291399
(3S)-N-methyl-N-[3-(methylamino)propyl]piperidine-3-carboxamide
CID 81134967
4-(aminomethyl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]cyclohexane-1-carboxamide
CID 62808378
N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
CID 50988968
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
N-(3,3-dimethylbutyl)-N-methylpiperidine-3-carboxamide
CID 115159936

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide?
The IUPAC name of N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide (CID 54868907) is N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide is CCCNC(=O)CN(C)C(=O)C1CCCNC1.
What is the InChIKey of N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide?
The InChIKey is BUANMAXBKCQCAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-3-6-14-11(16)9-15(2)12(17)10-5-4-7-13-8-10/h10,13H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide?
N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 54868907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).