3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride

C14H23Cl2N3O — CID 119946915

IUPAC3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride
SMILESCc1cccnc1CNC(=O)C1(C)CCCNC1.Cl.Cl
InChIInChI=1S/C14H21N3O.2ClH/c1-11-5-3-8-16-12(11)9-17-13(18)14(2)6-4-7-15-10-14;;/h3,5,8,15H,4,6-7,9-10H2,1-2H3,(H,17,18);2*1H
InChIKeyAVZBWANNHUTUGH-UHFFFAOYSA-N
MW320.26 g/mol
LogP2.24
Rot. Bonds3

About 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride

3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride (PubChem CID 119946915) has the molecular formula C14H23Cl2N3O and a molecular weight of 320.26 g/mol. Its IUPAC name is 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound Name3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride
PubChem CID119946915
Molecular FormulaC14H23Cl2N3O
Molecular Weight320.26 g/mol
Exact Mass319.12
IUPAC Name3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride
SMILESCc1cccnc1CNC(=O)C1(C)CCCNC1.Cl.Cl
InChIInChI=1S/C14H21N3O.2ClH/c1-11-5-3-8-16-12(11)9-17-13(18)14(2)6-4-7-15-10-14;;/h3,5,8,15H,4,6-7,9-10H2,1-2H3,(H,17,18);2*1H
InChIKeyAVZBWANNHUTUGH-UHFFFAOYSA-N
XLogP2.24
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.26
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-[(3-methyl-2-pyridinyl)methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119869384
(3R)-3-methyl-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide
CID 92864096
3-methyl-N-(pyridazin-3-ylmethyl)piperidine-3-carboxamide
CID 106896221
3-methyl-N-(2-pyridin-2-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119946078
3-methyl-N-[(3-methylphenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119944291
3-methyl-N-(2-pyridin-3-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119946421
3-methyl-N-(2-methyl-3-pyridinyl)piperidine-3-carboxamide
CID 79043969
3-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119944209
3-methyl-N-[2-(2-methylphenyl)ethyl]piperidine-3-carboxamide
CID 79749345
N-[(4-hydroxyphenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 113357142
N-[[3-(hydroxymethyl)phenyl]methyl]-3-methylpiperidine-3-carboxamide
CID 103822034
N-[(2-fluorophenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 55176835

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride?
The IUPAC name of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride (CID 119946915) is 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride.
What is the SMILES notation for 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride?
The canonical SMILES for 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride is Cc1cccnc1CNC(=O)C1(C)CCCNC1.Cl.Cl.
What is the InChIKey of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride?
The InChIKey is AVZBWANNHUTUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O.2ClH/c1-11-5-3-8-16-12(11)9-17-13(18)14(2)6-4-7-15-10-14;;/h3,5,8,15H,4,6-7,9-10H2,1-2H3,(H,17,18);2*1H.
What are the key properties of 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride?
3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride has a molecular weight of 320.26 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119946915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).