N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide

C14H27N3O — CID 107163930

IUPACN-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide
SMILESCN1CCC(C)(CNC(=O)C2CCCNC2)CC1
InChIInChI=1S/C14H27N3O/c1-14(5-8-17(2)9-6-14)11-16-13(18)12-4-3-7-15-10-12/h12,15H,3-11H2,1-2H3,(H,16,18)
InChIKeyOAZOBSJESVVIRV-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.83
Rot. Bonds3

About N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide

N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide (PubChem CID 107163930) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide
PubChem CID107163930
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide
SMILESCN1CCC(C)(CNC(=O)C2CCCNC2)CC1
InChIInChI=1S/C14H27N3O/c1-14(5-8-17(2)9-6-14)11-16-13(18)12-4-3-7-15-10-12/h12,15H,3-11H2,1-2H3,(H,16,18)
InChIKeyOAZOBSJESVVIRV-UHFFFAOYSA-N
XLogP0.83
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-[(1-methylcyclopropyl)methyl]pyrrolidine-3-carboxamide
CID 131134696
3-[(1,4-dimethylpiperidin-4-yl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 107164990
(3R)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]piperidine-3-carboxamide
CID 81133718
N-[(1-methyl-4-piperidin-1-ylpiperidin-4-yl)methyl]pyrrolidine-3-carboxamide;trihydrochloride
CID 119903563
N-[(1-ethylcyclopentyl)methyl]piperidine-3-carboxamide
CID 103797871
N-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-3-carboxamide;trihydrochloride
CID 119901172
(3R)-N-[(1-hydroxycyclobutyl)methyl]piperidine-3-carboxamide
CID 104874196
(3S)-N-[(2-methyloxolan-2-yl)methyl]piperidine-3-carboxamide
CID 81134846
(3R)-N-[(2-methyloxolan-2-yl)methyl]piperidine-3-carboxamide
CID 81134961
N-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide
CID 91660383
1-[[[(3R)-piperidine-3-carbonyl]amino]methyl]cyclobutane-1-carboxylic acid
CID 113311227
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852

Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide (CID 107163930) is N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide is CN1CCC(C)(CNC(=O)C2CCCNC2)CC1.
What is the InChIKey of N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide?
The InChIKey is OAZOBSJESVVIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-14(5-8-17(2)9-6-14)11-16-13(18)12-4-3-7-15-10-12/h12,15H,3-11H2,1-2H3,(H,16,18).
What are the key properties of N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide?
N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpiperidin-4-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 107163930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).