(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone

C11H20N2O2 — CID 82755754

IUPAC(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
SMILESCC1CCOC1C(=O)N1CCNC[C@H]1C
InChIInChI=1S/C11H20N2O2/c1-8-3-6-15-10(8)11(14)13-5-4-12-7-9(13)2/h8-10,12H,3-7H2,1-2H3/t8?,9-,10?/m1/s1
InChIKeyCWTLEEIRUKCWIM-HWOCKDDLSA-N
MW212.29 g/mol
LogP0.23
Rot. Bonds1

About (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone

(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone (PubChem CID 82755754) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone.

Molecular Properties

Compound Name(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
PubChem CID82755754
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone
SMILESCC1CCOC1C(=O)N1CCNC[C@H]1C
InChIInChI=1S/C11H20N2O2/c1-8-3-6-15-10(8)11(14)13-5-4-12-7-9(13)2/h8-10,12H,3-7H2,1-2H3/t8?,9-,10?/m1/s1
InChIKeyCWTLEEIRUKCWIM-HWOCKDDLSA-N
XLogP0.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(1R,2R)-2-methylcyclopropyl]-(2-methylpiperazin-1-yl)methanone
CID 155385369
1-[(2S)-2-methylpiperazin-1-yl]ethanone
CID 54446440
1-[(2R)-2-methylpiperazin-1-yl]ethanone
CID 55300442
7-bicyclo[4.1.0]heptanyl-[(2S)-2-methylpiperazin-1-yl]methanone
CID 82704835
6-bicyclo[3.1.0]hexanyl-(2-methylpiperazin-1-yl)methanone;hydrochloride
CID 119470839
(2-cyclopropylcyclopropyl)-(2-methylpiperazin-1-yl)methanone
CID 119473712
(2S)-2-methylpiperazine-1-carboxamide
CID 66855874
[(4R)-3,4-dihydro-2H-chromen-4-yl]-[(2S)-2-methylpiperazin-1-yl]methanone
CID 124556470
(2,2-difluorocyclopropyl)-[(2R)-2-methylpiperazin-1-yl]methanone
CID 165368993
1-(3-methyloxolane-2-carbonyl)-1,4-diazepan-5-one
CID 81448608
1-[(2R)-2-methylpiperazin-1-yl]-2-(oxolan-2-yl)ethanone
CID 82704997
[(2R)-2-methylpiperazin-1-yl]-(thiolan-3-yl)methanone
CID 82756247

Frequently Asked Questions

What is the IUPAC name of (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
The IUPAC name of (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone (CID 82755754) is (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone.
What is the SMILES notation for (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
The canonical SMILES for (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone is CC1CCOC1C(=O)N1CCNC[C@H]1C.
What is the InChIKey of (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
The InChIKey is CWTLEEIRUKCWIM-HWOCKDDLSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-8-3-6-15-10(8)11(14)13-5-4-12-7-9(13)2/h8-10,12H,3-7H2,1-2H3/t8?,9-,10?/m1/s1.
What are the key properties of (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone?
(3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone has a molecular weight of 212.29 g/mol, XLogP of 0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyloxolan-2-yl)-[(2R)-2-methylpiperazin-1-yl]methanone is sourced from PubChem (CID 82755754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).