2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone

C13H21N5O2 — CID 107047247

IUPAC2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone
SMILESCn1nnc(CC(=O)C2(N3CCOCC3)CCCC2)n1
InChIInChI=1S/C13H21N5O2/c1-17-15-12(14-16-17)10-11(19)13(4-2-3-5-13)18-6-8-20-9-7-18/h2-10H2,1H3
InChIKeyRHNSFEZEONWZQE-UHFFFAOYSA-N
MW279.34 g/mol
LogP-0.03
Rot. Bonds4

About 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone

2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone (PubChem CID 107047247) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone.

Molecular Properties

Compound Name2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone
PubChem CID107047247
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC Name2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone
SMILESCn1nnc(CC(=O)C2(N3CCOCC3)CCCC2)n1
InChIInChI=1S/C13H21N5O2/c1-17-15-12(14-16-17)10-11(19)13(4-2-3-5-13)18-6-8-20-9-7-18/h2-10H2,1H3
InChIKeyRHNSFEZEONWZQE-UHFFFAOYSA-N
XLogP-0.03
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 5-0.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone (CID 107047247) is 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone is Cn1nnc(CC(=O)C2(N3CCOCC3)CCCC2)n1.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone?
The InChIKey is RHNSFEZEONWZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-17-15-12(14-16-17)10-11(19)13(4-2-3-5-13)18-6-8-20-9-7-18/h2-10H2,1H3.
What are the key properties of 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone?
2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone has a molecular weight of 279.34 g/mol, XLogP of -0.03, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone is sourced from PubChem (CID 107047247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).