1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride

C13H27Cl2N3O — CID 120576315

IUPAC1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride
SMILESCC1NCCCC1NC(=O)C1CCN(C)CC1.Cl.Cl
InChIInChI=1S/C13H25N3O.2ClH/c1-10-12(4-3-7-14-10)15-13(17)11-5-8-16(2)9-6-11;;/h10-12,14H,3-9H2,1-2H3,(H,15,17);2*1H
InChIKeyJPJPOAOWCIMEMW-UHFFFAOYSA-N
MW312.29 g/mol
LogP1.43
Rot. Bonds2

About 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride

1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride (PubChem CID 120576315) has the molecular formula C13H27Cl2N3O and a molecular weight of 312.29 g/mol. Its IUPAC name is 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound Name1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride
PubChem CID120576315
Molecular FormulaC13H27Cl2N3O
Molecular Weight312.29 g/mol
Exact Mass311.15
IUPAC Name1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride
SMILESCC1NCCCC1NC(=O)C1CCN(C)CC1.Cl.Cl
InChIInChI=1S/C13H25N3O.2ClH/c1-10-12(4-3-7-14-10)15-13(17)11-5-8-16(2)9-6-11;;/h10-12,14H,3-9H2,1-2H3,(H,15,17);2*1H
InChIKeyJPJPOAOWCIMEMW-UHFFFAOYSA-N
XLogP1.43
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.29
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpiperidin-3-yl)cyclopent-3-ene-1-carboxamide
CID 114694966
1-(2,4-difluorobenzoyl)-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;hydrochloride
CID 120577832
N-(2-methylpiperidin-3-yl)-4-phenylcyclohexane-1-carboxamide
CID 120576328
1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide
CID 120577777
N-(2-methylpiperidin-3-yl)prop-2-ynamide
CID 114694858
1-benzoyl-N-(2-methylpiperidin-3-yl)piperidine-3-carboxamide;hydrochloride
CID 120577067
1-(4-methylcyclohexyl)-N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
CID 120577525
1,1-dimethyl-3-[(2R,3R)-2-methylpiperidin-3-yl]urea
CID 118114950
N-(2-methylpiperidin-3-yl)-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 120575634
N-(2-methylpiperidin-3-yl)-5-oxopyrrolidine-2-carboxamide
CID 114695087
3-methyl-N-(2-methylpiperidin-3-yl)piperidine-1-carboxamide
CID 79159344
1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide
CID 115277550

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride?
The IUPAC name of 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride (CID 120576315) is 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride?
The canonical SMILES for 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride is CC1NCCCC1NC(=O)C1CCN(C)CC1.Cl.Cl.
What is the InChIKey of 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride?
The InChIKey is JPJPOAOWCIMEMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O.2ClH/c1-10-12(4-3-7-14-10)15-13(17)11-5-8-16(2)9-6-11;;/h10-12,14H,3-9H2,1-2H3,(H,15,17);2*1H.
What are the key properties of 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride?
1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride has a molecular weight of 312.29 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methylpiperidin-3-yl)piperidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 120576315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).