1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone

C10H17N5O2 — CID 107062229

IUPAC1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone
SMILESCCNC1COCC1C(=O)Cc1nnn(C)n1
InChIInChI=1S/C10H17N5O2/c1-3-11-8-6-17-5-7(8)9(16)4-10-12-14-15(2)13-10/h7-8,11H,3-6H2,1-2H3
InChIKeyJDZZFLAHTVWFMU-UHFFFAOYSA-N
MW239.28 g/mol
LogP-1.05
Rot. Bonds5

About 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone

1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone (PubChem CID 107062229) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone.

Molecular Properties

Compound Name1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone
PubChem CID107062229
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone
SMILESCCNC1COCC1C(=O)Cc1nnn(C)n1
InChIInChI=1S/C10H17N5O2/c1-3-11-8-6-17-5-7(8)9(16)4-10-12-14-15(2)13-10/h7-8,11H,3-6H2,1-2H3
InChIKeyJDZZFLAHTVWFMU-UHFFFAOYSA-N
XLogP-1.05
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-1.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone?
The IUPAC name of 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone (CID 107062229) is 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone.
What is the SMILES notation for 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone?
The canonical SMILES for 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone is CCNC1COCC1C(=O)Cc1nnn(C)n1.
What is the InChIKey of 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone?
The InChIKey is JDZZFLAHTVWFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-3-11-8-6-17-5-7(8)9(16)4-10-12-14-15(2)13-10/h7-8,11H,3-6H2,1-2H3.
What are the key properties of 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone?
1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone has a molecular weight of 239.28 g/mol, XLogP of -1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(ethylamino)oxolan-3-yl]-2-(2-methyltetrazol-5-yl)ethanone is sourced from PubChem (CID 107062229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).