[4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone

C13H24N2O3 — CID 66260210

IUPAC[4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
SMILESCCNC1COCC1C(=O)N1CCCC(CO)C1
InChIInChI=1S/C13H24N2O3/c1-2-14-12-9-18-8-11(12)13(17)15-5-3-4-10(6-15)7-16/h10-12,14,16H,2-9H2,1H3
InChIKeyXTPPOTZWBKTPAE-UHFFFAOYSA-N
MW256.35 g/mol
LogP-0.16
Rot. Bonds4

About [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone

[4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone (PubChem CID 66260210) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name[4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
PubChem CID66260210
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name[4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
SMILESCCNC1COCC1C(=O)N1CCCC(CO)C1
InChIInChI=1S/C13H24N2O3/c1-2-14-12-9-18-8-11(12)13(17)15-5-3-4-10(6-15)7-16/h10-12,14,16H,2-9H2,1H3
InChIKeyXTPPOTZWBKTPAE-UHFFFAOYSA-N
XLogP-0.16
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 107217226
[4-(ethylamino)oxolan-3-yl]-(4-propan-2-ylazepan-1-yl)methanone
CID 66257568
1,4-diazepan-1-yl-[4-(ethylamino)oxolan-3-yl]methanone
CID 66259246
[4-(ethylamino)oxolan-3-yl]-(1,4-oxazepan-4-yl)methanone
CID 66260265
[4-(ethylamino)oxolan-3-yl]-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 106835851
[4-(ethylamino)oxolan-3-yl]-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103495367
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-[4-(propylamino)oxolan-3-yl]methanone
CID 114797463
[4-(diethylamino)piperidin-1-yl]-[4-(ethylamino)oxolan-3-yl]methanone
CID 66258113
[1-[4-(methylamino)oxolane-3-carbonyl]piperidin-3-yl]methylurea
CID 66265033
N-ethyl-1-[4-(ethylamino)oxolane-3-carbonyl]piperidine-4-carboxamide
CID 66257526
(3-hydroxypiperidin-1-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 66267351
(2-ethyloxolan-3-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 114104218

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone?
The IUPAC name of [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone (CID 66260210) is [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone is CCNC1COCC1C(=O)N1CCCC(CO)C1.
What is the InChIKey of [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone?
The InChIKey is XTPPOTZWBKTPAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-2-14-12-9-18-8-11(12)13(17)15-5-3-4-10(6-15)7-16/h10-12,14,16H,2-9H2,1H3.
What are the key properties of [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone?
[4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone has a molecular weight of 256.35 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)oxolan-3-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 66260210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).