1,3-dimethylpiperidine-4-carboxamide;ethane

C10H22N2O — CID 166075774

IUPAC1,3-dimethylpiperidine-4-carboxamide;ethane
SMILESCC.CC1CN(C)CCC1C(N)=O
InChIInChI=1S/C8H16N2O.C2H6/c1-6-5-10(2)4-3-7(6)8(9)11;1-2/h6-7H,3-5H2,1-2H3,(H2,9,11);1-2H3
InChIKeyGJGMOKZXBHIPEO-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.09
Rot. Bonds1

About 1,3-dimethylpiperidine-4-carboxamide;ethane

1,3-dimethylpiperidine-4-carboxamide;ethane (PubChem CID 166075774) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1,3-dimethylpiperidine-4-carboxamide;ethane.

Molecular Properties

Compound Name1,3-dimethylpiperidine-4-carboxamide;ethane
PubChem CID166075774
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1,3-dimethylpiperidine-4-carboxamide;ethane
SMILESCC.CC1CN(C)CCC1C(N)=O
InChIInChI=1S/C8H16N2O.C2H6/c1-6-5-10(2)4-3-7(6)8(9)11;1-2/h6-7H,3-5H2,1-2H3,(H2,9,11);1-2H3
InChIKeyGJGMOKZXBHIPEO-UHFFFAOYSA-N
XLogP1.09
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4R)-4-[(Z)-but-2-en-2-yl]-1,3-dimethylpiperidine
CID 178147290
ethane;1,3,4-trimethylpiperidine
CID 142222872
(1,3-dimethylpiperidin-4-yl) acetate
CID 20696711
(1R,2R,4S)-2,4-dimethylcyclohexane-1-carboxamide;ethane
CID 91164443
3-fluoro-1-methylpiperidine-4-carboxylic acid
CID 83854511
1,3,4-trimethylpiperidine
CID 14454423
(3S,4R)-1,3,4-trimethylpiperidine
CID 14454424
(3R)-1,3-dimethylpyrrolidine;ethane
CID 90814408
(3R,4R)-1,3-dimethylpiperidin-4-amine
CID 98186941
1,3-dimethylpiperidin-4-amine;ethane;molecular hydrogen
CID 176946053
1,3-dimethylpiperidin-4-amine;dihydrochloride
CID 53407082
1,4-dimethylpiperidin-3-amine;ethane
CID 169133952

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethylpiperidine-4-carboxamide;ethane?
The IUPAC name of 1,3-dimethylpiperidine-4-carboxamide;ethane (CID 166075774) is 1,3-dimethylpiperidine-4-carboxamide;ethane.
What is the SMILES notation for 1,3-dimethylpiperidine-4-carboxamide;ethane?
The canonical SMILES for 1,3-dimethylpiperidine-4-carboxamide;ethane is CC.CC1CN(C)CCC1C(N)=O.
What is the InChIKey of 1,3-dimethylpiperidine-4-carboxamide;ethane?
The InChIKey is GJGMOKZXBHIPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.C2H6/c1-6-5-10(2)4-3-7(6)8(9)11;1-2/h6-7H,3-5H2,1-2H3,(H2,9,11);1-2H3.
What are the key properties of 1,3-dimethylpiperidine-4-carboxamide;ethane?
1,3-dimethylpiperidine-4-carboxamide;ethane has a molecular weight of 186.30 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethylpiperidine-4-carboxamide;ethane is sourced from PubChem (CID 166075774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).