[4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone

C15H29N3O2 — CID 66258499

IUPAC[4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone
SMILESCCNC1COCC1C(=O)N1CCN(CC(C)C)CC1
InChIInChI=1S/C15H29N3O2/c1-4-16-14-11-20-10-13(14)15(19)18-7-5-17(6-8-18)9-12(2)3/h12-14,16H,4-11H2,1-3H3
InChIKeySOXCKNSTCCQUJC-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.41
Rot. Bonds5

About [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone

[4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone (PubChem CID 66258499) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone
PubChem CID66258499
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name[4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone
SMILESCCNC1COCC1C(=O)N1CCN(CC(C)C)CC1
InChIInChI=1S/C15H29N3O2/c1-4-16-14-11-20-10-13(14)15(19)18-7-5-17(6-8-18)9-12(2)3/h12-14,16H,4-11H2,1-3H3
InChIKeySOXCKNSTCCQUJC-UHFFFAOYSA-N
XLogP0.41
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(ethylamino)oxolan-3-yl]-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103495367
[4-(ethylamino)oxolan-3-yl]-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 106835851
[4-(ethylamino)oxolan-3-yl]-(4-propan-2-ylazepan-1-yl)methanone
CID 66257568
[4-(ethylamino)oxolan-3-yl]-(1,4-oxazepan-4-yl)methanone
CID 66260265
[4-(diethylamino)piperidin-1-yl]-[4-(ethylamino)oxolan-3-yl]methanone
CID 66258113
[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 107217226
3-azaspiro[5.5]undecan-3-yl-[4-(ethylamino)oxolan-3-yl]methanone
CID 66259879
N-ethyl-1-[4-(ethylamino)oxolane-3-carbonyl]piperidine-4-carboxamide
CID 66257526
1,4-diazepan-1-yl-[4-(ethylamino)oxolan-3-yl]methanone
CID 66259246
N-ethyl-4-[[4-(2-methylpropyl)piperazin-1-yl]methyl]oxolan-3-amine
CID 66258964
1-[4-(ethylamino)oxolan-3-yl]-3-methylbutan-1-one
CID 116587978
[4-(propylamino)oxolan-3-yl]-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 66254425

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone?
The IUPAC name of [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone (CID 66258499) is [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone.
What is the SMILES notation for [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone?
The canonical SMILES for [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone is CCNC1COCC1C(=O)N1CCN(CC(C)C)CC1.
What is the InChIKey of [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone?
The InChIKey is SOXCKNSTCCQUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-4-16-14-11-20-10-13(14)15(19)18-7-5-17(6-8-18)9-12(2)3/h12-14,16H,4-11H2,1-3H3.
What are the key properties of [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone?
[4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone has a molecular weight of 283.42 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)oxolan-3-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone is sourced from PubChem (CID 66258499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).