1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone

C13H24N2O2 — CID 1439792

IUPAC1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
SMILESC[C@H]1CCCCN1C(=O)CNC[C@H]1CCCO1
InChIInChI=1S/C13H24N2O2/c1-11-5-2-3-7-15(11)13(16)10-14-9-12-6-4-8-17-12/h11-12,14H,2-10H2,1H3/t11-,12+/m0/s1
InChIKeyVPVPORIIUNWQQE-NWDGAFQWSA-N
MW240.35 g/mol
LogP1.16
Rot. Bonds4

About 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone

1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone (PubChem CID 1439792) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone.

Molecular Properties

Compound Name1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
PubChem CID1439792
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
SMILESC[C@H]1CCCCN1C(=O)CNC[C@H]1CCCO1
InChIInChI=1S/C13H24N2O2/c1-11-5-2-3-7-15(11)13(16)10-14-9-12-6-4-8-17-12/h11-12,14H,2-10H2,1H3/t11-,12+/m0/s1
InChIKeyVPVPORIIUNWQQE-NWDGAFQWSA-N
XLogP1.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(azepan-1-yl)-2-[[(2R)-oxolan-2-yl]methylamino]ethanone
CID 7437129
2-(oxan-2-ylmethylamino)-1-piperidin-1-ylethanone
CID 54948766
1-(2-methylpiperidin-1-yl)-2-(2,2,2-trifluoroethylamino)ethanone
CID 78914825
1-(5-ethyl-2-methylmorpholin-4-yl)-2-(oxolan-2-ylmethylamino)ethanone
CID 119682256
(2R)-2-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]piperidine-1-carboxamide
CID 95637959
2-(methylamino)-1-(2-methylpiperidin-1-yl)ethanone
CID 24702742
N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 7437120
1-[(2R,4S)-2-methyl-4-(2-methylphenyl)pyrrolidin-1-yl]-2-[[(2S)-oxolan-2-yl]methylamino]ethanone
CID 124693644
methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate
CID 28585559
2-[(2S)-2-methylpiperidin-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 51980847
1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-3-(oxolan-2-yl)propan-1-one
CID 55608937
N-cyclooctyl-2-(oxolan-2-ylmethylamino)acetamide
CID 119674119

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone?
The IUPAC name of 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone (CID 1439792) is 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone.
What is the SMILES notation for 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone?
The canonical SMILES for 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone is C[C@H]1CCCCN1C(=O)CNC[C@H]1CCCO1.
What is the InChIKey of 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone?
The InChIKey is VPVPORIIUNWQQE-NWDGAFQWSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-11-5-2-3-7-15(11)13(16)10-14-9-12-6-4-8-17-12/h11-12,14H,2-10H2,1H3/t11-,12+/m0/s1.
What are the key properties of 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone?
1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone has a molecular weight of 240.35 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-methylpiperidin-1-yl]-2-[[(2R)-oxolan-2-yl]methylamino]ethanone is sourced from PubChem (CID 1439792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).