(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide

C13H25N3O — CID 104913856

IUPAC(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide
SMILESCN1CCCC(N(C)C(=O)[C@H]2CCCCN2)C1
InChIInChI=1S/C13H25N3O/c1-15-9-5-6-11(10-15)16(2)13(17)12-7-3-4-8-14-12/h11-12,14H,3-10H2,1-2H3/t11?,12-/m1/s1
InChIKeySXARZMNYQWKRFM-PIJUOVFKSA-N
MW239.36 g/mol
LogP0.68
Rot. Bonds2

About (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide

(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide (PubChem CID 104913856) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide
PubChem CID104913856
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide
SMILESCN1CCCC(N(C)C(=O)[C@H]2CCCCN2)C1
InChIInChI=1S/C13H25N3O/c1-15-9-5-6-11(10-15)16(2)13(17)12-7-3-4-8-14-12/h11-12,14H,3-10H2,1-2H3/t11?,12-/m1/s1
InChIKeySXARZMNYQWKRFM-PIJUOVFKSA-N
XLogP0.68
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 62546250
N-cyclohexyl-N,4-dimethylpiperazine-2-carboxamide
CID 115177979
(2R)-N-[(2R,4S)-1,2-dimethylpiperidin-4-yl]-N-methylpiperidine-2-carboxamide
CID 125119897
(2S)-N-cyclohexyl-N-methylpyrrolidine-2-carboxamide
CID 23520170
N-methyl-N-(thian-4-yl)piperidine-2-carboxamide
CID 121203607
(2S)-N-[(2S,4R)-1,2-dimethylpiperidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 124693314
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 55174038
N-cyclobutyl-N-methylazetidine-2-carboxamide
CID 130908967
(2S)-N-(4-ethylcyclohexyl)-N-methylpiperidine-2-carboxamide
CID 93456348
(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone
CID 116916943
N-methyl-N-(oxan-4-yl)piperidine-2-carboxamide
CID 43611075
(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide
CID 103807849

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide?
The IUPAC name of (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide (CID 104913856) is (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide is CN1CCCC(N(C)C(=O)[C@H]2CCCCN2)C1.
What is the InChIKey of (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide?
The InChIKey is SXARZMNYQWKRFM-PIJUOVFKSA-N. The full InChI is InChI=1S/C13H25N3O/c1-15-9-5-6-11(10-15)16(2)13(17)12-7-3-4-8-14-12/h11-12,14H,3-10H2,1-2H3/t11?,12-/m1/s1.
What are the key properties of (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide?
(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide is sourced from PubChem (CID 104913856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).