3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide

C12H22N2O2 — CID 115871728

IUPAC3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NC2CCOC2)CC1C
InChIInChI=1S/C12H22N2O2/c1-9-3-5-14(7-10(9)2)12(15)13-11-4-6-16-8-11/h9-11H,3-8H2,1-2H3,(H,13,15)
InChIKeyQGGNFIAISCIBKV-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.46
Rot. Bonds1

About 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide

3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide (PubChem CID 115871728) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide
PubChem CID115871728
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NC2CCOC2)CC1C
InChIInChI=1S/C12H22N2O2/c1-9-3-5-14(7-10(9)2)12(15)13-11-4-6-16-8-11/h9-11H,3-8H2,1-2H3,(H,13,15)
InChIKeyQGGNFIAISCIBKV-UHFFFAOYSA-N
XLogP1.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(oxolan-3-yl)-1,4-oxazepane-4-carboxamide
CID 115760659
N-(oxolan-3-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide
CID 115760770
4-(acetamidomethyl)-N-(oxolan-3-yl)piperidine-1-carboxamide
CID 103839211
N-cyclopropyl-4-hydroxy-3-methylpiperidine-1-carboxamide
CID 114501609
6-oxo-N-(oxolan-3-yl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-2-carboxamide
CID 116657207
(3S,4R)-3,4-dimethyl-N-[(2R)-1-[(3R)-oxolan-3-yl]oxypropan-2-yl]piperidine-1-carboxamide
CID 124777099
(3S,4S)-3,4-dimethyl-N-[(2R)-1-[(3R)-oxolan-3-yl]oxypropan-2-yl]piperidine-1-carboxamide
CID 124777101
N-cyclopentyl-3-hydroxy-4-methylpiperidine-1-carboxamide
CID 103896284
N-cyclopropyl-3-hydroxypyrrolidine-1-carboxamide
CID 62916085
methyl 3-[4-(oxolan-3-ylcarbamoyl)piperazin-1-yl]propanoate
CID 115536102
(3R)-1-(oxan-3-ylcarbamoyl)piperidine-3-carboxylic acid
CID 81120821
4-(3-aminopyrazol-1-yl)-N-(oxolan-3-yl)piperidine-1-carboxamide
CID 107109508

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide?
The IUPAC name of 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide (CID 115871728) is 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide?
The canonical SMILES for 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide is CC1CCN(C(=O)NC2CCOC2)CC1C.
What is the InChIKey of 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide?
The InChIKey is QGGNFIAISCIBKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9-3-5-14(7-10(9)2)12(15)13-11-4-6-16-8-11/h9-11H,3-8H2,1-2H3,(H,13,15).
What are the key properties of 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide?
3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-(oxolan-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 115871728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).