2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide

C10H17N3O — CID 79159844

IUPAC2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide
SMILESCCN(C)C(=O)N1CCCCC1C#N
InChIInChI=1S/C10H17N3O/c1-3-12(2)10(14)13-7-5-4-6-9(13)8-11/h9H,3-7H2,1-2H3
InChIKeyCGUCUSNXMOHSHM-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.44
Rot. Bonds1

About 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide

2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide (PubChem CID 79159844) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide
PubChem CID79159844
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide
SMILESCCN(C)C(=O)N1CCCCC1C#N
InChIInChI=1S/C10H17N3O/c1-3-12(2)10(14)13-7-5-4-6-9(13)8-11/h9H,3-7H2,1-2H3
InChIKeyCGUCUSNXMOHSHM-UHFFFAOYSA-N
XLogP1.44
TPSA47.34 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]-methylamino]acetyl]pyrrolidine-2-carbonitrile
CID 90655547
(2S)-1-acetylazepane-2-carbonitrile
CID 125042026
1-(2-bromoacetyl)pyrrolidine-2-carbonitrile;propane
CID 142254427
1-(2-aminoacetyl)piperidine-2-carbonitrile;butan-1-amine
CID 142937073
2-cyclopentyl-N-ethyl-N-methylpyrrolidine-1-carboxamide
CID 116655257
N-ethyl-N-methyl-2-(2-oxopropyl)azepane-1-carboxamide
CID 79553142
1-[4-[(2S)-2-cyanopyrrolidin-1-yl]-4-oxobut-2-enoyl]pyrrolidine-2-carbonitrile
CID 91003836
1-(3-ethylthiophene-2-carbonyl)piperidine-2-carbonitrile
CID 79975737
tert-butyl (2R)-2-cyanopiperidine-1-carboxylate
CID 7019482
N-ethyl-2-(2-hydroxypropyl)-N-methylazepane-1-carboxamide
CID 79559941
N-ethyl-N-methyl-2-(2-oxocyclohexyl)piperidine-1-carboxamide
CID 79553640
1-[2-[amino(propan-2-yl)amino]acetyl]pyrrolidine-2-carbonitrile
CID 10149801

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide?
The IUPAC name of 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide (CID 79159844) is 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide?
The canonical SMILES for 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide is CCN(C)C(=O)N1CCCCC1C#N.
What is the InChIKey of 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide?
The InChIKey is CGUCUSNXMOHSHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-12(2)10(14)13-7-5-4-6-9(13)8-11/h9H,3-7H2,1-2H3.
What are the key properties of 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide?
2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide has a molecular weight of 195.27 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-ethyl-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 79159844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).