2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone

C14H23N5O — CID 107047245

IUPAC2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone
SMILESCn1nnc(CC(=O)C2(N3CCCCC3)CCCC2)n1
InChIInChI=1S/C14H23N5O/c1-18-16-13(15-17-18)11-12(20)14(7-3-4-8-14)19-9-5-2-6-10-19/h2-11H2,1H3
InChIKeyNLRGSFRTYIWWQC-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.12
Rot. Bonds4

About 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone

2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone (PubChem CID 107047245) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone.

Molecular Properties

Compound Name2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone
PubChem CID107047245
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone
SMILESCn1nnc(CC(=O)C2(N3CCCCC3)CCCC2)n1
InChIInChI=1S/C14H23N5O/c1-18-16-13(15-17-18)11-12(20)14(7-3-4-8-14)19-9-5-2-6-10-19/h2-11H2,1H3
InChIKeyNLRGSFRTYIWWQC-UHFFFAOYSA-N
XLogP1.12
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone with MolForge

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Related Compounds

1-(2-methyltetrazol-5-yl)-3-[(3S)-1-propan-2-ylpiperidin-3-yl]propan-2-one
CID 158958791
3-(Dimethylamino)-3-methyl-1-(2-methyltetrazol-5-yl)pentan-2-one
CID 107047217
3-Methyl-1-(2-methyltetrazol-5-yl)-3-piperidin-1-ylpentan-2-one
CID 107047226
3-(Dimethylamino)-3-ethyl-1-(2-methyltetrazol-5-yl)pentan-2-one
CID 107047230
3-(Diethylamino)-3-ethyl-1-(2-methyltetrazol-5-yl)pentan-2-one
CID 107047232
1-[1-(Dimethylamino)cyclopentyl]-2-(2-methyltetrazol-5-yl)ethanone
CID 107047238
1-[1-(Diethylamino)cyclopentyl]-2-(2-methyltetrazol-5-yl)ethanone
CID 107047240
2-(2-Methyltetrazol-5-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanone
CID 107047241
2-(2-Methyltetrazol-5-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanone
CID 107047247
1-[1-(Dimethylamino)-4-methylcyclohexyl]-2-(2-methyltetrazol-5-yl)ethanone
CID 107047251
1-[1-(Dimethylamino)-3-methylcyclohexyl]-2-(2-methyltetrazol-5-yl)ethanone
CID 107047253
1-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107047441

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone?
The IUPAC name of 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone (CID 107047245) is 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone.
What is the SMILES notation for 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone?
The canonical SMILES for 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone is Cn1nnc(CC(=O)C2(N3CCCCC3)CCCC2)n1.
What is the InChIKey of 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone?
The InChIKey is NLRGSFRTYIWWQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-18-16-13(15-17-18)11-12(20)14(7-3-4-8-14)19-9-5-2-6-10-19/h2-11H2,1H3.
What are the key properties of 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone?
2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone has a molecular weight of 277.37 g/mol, XLogP of 1.12, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyltetrazol-5-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanone is sourced from PubChem (CID 107047245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).