(3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide

C12H22N2O2 — CID 81140626

IUPAC(3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide
SMILESCN(CC1CCCO1)C(=O)[C@@H]1CCCNC1
InChIInChI=1S/C12H22N2O2/c1-14(9-11-5-3-7-16-11)12(15)10-4-2-6-13-8-10/h10-11,13H,2-9H2,1H3/t10-,11?/m1/s1
InChIKeyMJGRCZLEMJCRDH-NFJWQWPMSA-N
MW226.32 g/mol
LogP0.62
Rot. Bonds3

About (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide

(3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide (PubChem CID 81140626) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide
PubChem CID81140626
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name(3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide
SMILESCN(CC1CCCO1)C(=O)[C@@H]1CCCNC1
InChIInChI=1S/C12H22N2O2/c1-14(9-11-5-3-7-16-11)12(15)10-4-2-6-13-8-10/h10-11,13H,2-9H2,1H3/t10-,11?/m1/s1
InChIKeyMJGRCZLEMJCRDH-NFJWQWPMSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide
CID 119336156
N-(4-methylcyclohexyl)-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 119336171
N-methyl-N-(oxolan-2-ylmethyl)morpholine-2-carboxamide;hydrochloride
CID 119708798
(3S)-N-methyl-N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 81140981
N-methyl-N-(oxan-3-ylmethyl)piperidine-3-carboxamide
CID 55227214
N-methyl-N-(oxan-2-ylmethyl)cyclopropanecarboxamide
CID 61150958
3-[methyl(oxolan-2-ylmethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 55236563
(2R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-2-carboxamide
CID 103808733
(3R)-N-methyl-N-[(2-methylcyclopropyl)methyl]piperidine-3-carboxamide
CID 81139885
N,2-dimethyl-N-(oxolan-2-ylmethyl)pyrrolidine-3-carboxamide
CID 79388240
N-methyl-N-(oxan-2-ylmethyl)-6-oxopiperidine-3-carboxamide
CID 113226309
N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
CID 50988968

Frequently Asked Questions

What is the IUPAC name of (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide (CID 81140626) is (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide is CN(CC1CCCO1)C(=O)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide?
The InChIKey is MJGRCZLEMJCRDH-NFJWQWPMSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-14(9-11-5-3-7-16-11)12(15)10-4-2-6-13-8-10/h10-11,13H,2-9H2,1H3/t10-,11?/m1/s1.
What are the key properties of (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide?
(3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-methyl-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 81140626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).