3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride

C12H19ClN2O2 — CID 120577222

IUPAC3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride
SMILESCc1ccoc1C(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C12H18N2O2.ClH/c1-8-5-7-16-11(8)12(15)14-10-4-3-6-13-9(10)2;/h5,7,9-10,13H,3-4,6H2,1-2H3,(H,14,15);1H
InChIKeySJFHLKQTVFEUSK-UHFFFAOYSA-N
MW258.75 g/mol
LogP1.88
Rot. Bonds2

About 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride

3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride (PubChem CID 120577222) has the molecular formula C12H19ClN2O2 and a molecular weight of 258.75 g/mol. Its IUPAC name is 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride
PubChem CID120577222
Molecular FormulaC12H19ClN2O2
Molecular Weight258.75 g/mol
Exact Mass258.11
IUPAC Name3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride
SMILESCc1ccoc1C(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C12H18N2O2.ClH/c1-8-5-7-16-11(8)12(15)14-10-4-3-6-13-9(10)2;/h5,7,9-10,13H,3-4,6H2,1-2H3,(H,14,15);1H
InChIKeySJFHLKQTVFEUSK-UHFFFAOYSA-N
XLogP1.88
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(2-methylpiperidin-3-yl)-1,2-oxazole-5-carboxamide
CID 114695110
N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]-3-methylfuran-2-carboxamide
CID 76978371
3-methyl-N-(4-methylpyrrolidin-3-yl)furan-2-carboxamide
CID 104826170
2,3-dimethyl-N-(2-methylpiperidin-3-yl)benzamide
CID 79042389
N-cyclopropyl-3-methylfuran-2-carboxamide
CID 60675996
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
3-bromo-4-methyl-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120575414
N-(2-aminocyclopropyl)-3-methylfuran-2-carboxamide
CID 43593745
2-methyl-N-(2-methylpiperidin-3-yl)-5-methylsulfanylbenzamide;hydrochloride
CID 120574172
3-methyl-N-[(2S,3S)-2-methylpiperidin-3-yl]benzamide
CID 124515685
2-methyl-N-(2-methylpiperidin-3-yl)-5-nitrobenzamide;hydrochloride
CID 120577307
3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide
CID 107098369

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride?
The IUPAC name of 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride (CID 120577222) is 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride.
What is the SMILES notation for 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride?
The canonical SMILES for 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride is Cc1ccoc1C(=O)NC1CCCNC1C.Cl.
What is the InChIKey of 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride?
The InChIKey is SJFHLKQTVFEUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2.ClH/c1-8-5-7-16-11(8)12(15)14-10-4-3-6-13-9(10)2;/h5,7,9-10,13H,3-4,6H2,1-2H3,(H,14,15);1H.
What are the key properties of 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride?
3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide;hydrochloride is sourced from PubChem (CID 120577222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).