(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide

C11H20N2O2 — CID 93224848

IUPAC(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide
SMILESCN(C(=O)[C@H]1CCCN1)C1CCOCC1
InChIInChI=1S/C11H20N2O2/c1-13(9-4-7-15-8-5-9)11(14)10-3-2-6-12-10/h9-10,12H,2-8H2,1H3/t10-/m1/s1
InChIKeyKQRVDKWXKGKADZ-SNVBAGLBSA-N
MW212.29 g/mol
LogP0.38
Rot. Bonds2

About (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide

(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide (PubChem CID 93224848) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide
PubChem CID93224848
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide
SMILESCN(C(=O)[C@H]1CCCN1)C1CCOCC1
InChIInChI=1S/C11H20N2O2/c1-13(9-4-7-15-8-5-9)11(14)10-3-2-6-12-10/h9-10,12H,2-8H2,1H3/t10-/m1/s1
InChIKeyKQRVDKWXKGKADZ-SNVBAGLBSA-N
XLogP0.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(oxan-4-yl)piperidine-2-carboxamide
CID 43611075
N-methyl-N-(oxolan-3-yl)piperidine-2-carboxamide
CID 82738037
(2S)-N-cyclohexyl-N-methylpyrrolidine-2-carboxamide
CID 23520170
N-cyclobutyl-N-methylazetidine-2-carboxamide
CID 130908967
(2S)-N-methyl-N-(3-methylcyclohexyl)pyrrolidine-2-carboxamide
CID 61447107
N-methyl-N-(thian-4-yl)piperidine-2-carboxamide
CID 121203607
N,N-dimethylpyrrolidine-2-carboxamide
CID 14282308
(2S)-N-[(2S,4R)-1,2-dimethylpiperidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 124693314
(2S)-N-(4-ethylcyclohexyl)-N-methylpiperidine-2-carboxamide
CID 93456348
(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpyrrolidine-2-carboxamide
CID 22691367
N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 62546250
(2S)-N,N-dimethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 143692131

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide (CID 93224848) is (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide is CN(C(=O)[C@H]1CCCN1)C1CCOCC1.
What is the InChIKey of (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide?
The InChIKey is KQRVDKWXKGKADZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-13(9-4-7-15-8-5-9)11(14)10-3-2-6-12-10/h9-10,12H,2-8H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide?
(2R)-N-methyl-N-(oxan-4-yl)pyrrolidine-2-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.38, 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-(oxan-4-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 93224848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).