[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone

C15H28N2O2 — CID 114506649

IUPAC[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone
SMILESCCNC1CCN(C(=O)C2OCCC2C)CC1CC
InChIInChI=1S/C15H28N2O2/c1-4-12-10-17(8-6-13(12)16-5-2)15(18)14-11(3)7-9-19-14/h11-14,16H,4-10H2,1-3H3
InChIKeyHUVFTDMPZUBYPB-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds4

About [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone

[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone (PubChem CID 114506649) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone.

Molecular Properties

Compound Name[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone
PubChem CID114506649
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone
SMILESCCNC1CCN(C(=O)C2OCCC2C)CC1CC
InChIInChI=1S/C15H28N2O2/c1-4-12-10-17(8-6-13(12)16-5-2)15(18)14-11(3)7-9-19-14/h11-14,16H,4-10H2,1-3H3
InChIKeyHUVFTDMPZUBYPB-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone
CID 114498603
(3-chloro-4-methylpiperidin-1-yl)-(3-methyloxolan-2-yl)methanone
CID 102961746
ethyl 3-ethyl-4-(ethylamino)piperidine-1-carboxylate
CID 114506999
(3-amino-4-methylpyrrolidin-1-yl)-(3-methyloxolan-2-yl)methanone
CID 103575749
1-[3-ethyl-4-(ethylamino)piperidin-1-yl]-3,3,3-trifluoropropan-1-one
CID 114506809
2-cyclohexyl-1-[3-ethyl-4-(ethylamino)piperidin-1-yl]ethanone
CID 114506671
3-methyl-1-(3-methyloxolane-2-carbonyl)piperidin-4-one
CID 114499767
(1,5-dimethylpyrazol-4-yl)-[3-ethyl-4-(ethylamino)piperidin-1-yl]methanone
CID 114506616
1-[3-ethyl-4-(ethylamino)piperidin-1-yl]-2-methyl-2-methylsulfonylpropan-1-one
CID 114506784
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(furan-2-yl)methanone
CID 114506827
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 103115707
2-[3-ethyl-4-(ethylamino)piperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 114507471

Frequently Asked Questions

What is the IUPAC name of [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone?
The IUPAC name of [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone (CID 114506649) is [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone.
What is the SMILES notation for [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone?
The canonical SMILES for [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone is CCNC1CCN(C(=O)C2OCCC2C)CC1CC.
What is the InChIKey of [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone?
The InChIKey is HUVFTDMPZUBYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-4-12-10-17(8-6-13(12)16-5-2)15(18)14-11(3)7-9-19-14/h11-14,16H,4-10H2,1-3H3.
What are the key properties of [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone?
[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone has a molecular weight of 268.40 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone is sourced from PubChem (CID 114506649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).