[2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone

C16H21N5O — CID 154843796

IUPAC[2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
SMILESO=C(c1cccn2nnnc12)N1CCCCC1CC1CCC1
InChIInChI=1S/C16H21N5O/c22-16(14-8-4-10-21-15(14)17-18-19-21)20-9-2-1-7-13(20)11-12-5-3-6-12/h4,8,10,12-13H,1-3,5-7,9,11H2
InChIKeyVNMZBINOIPEICH-UHFFFAOYSA-N
MW299.38 g/mol
LogP2.31
Rot. Bonds3

About [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone

[2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone (PubChem CID 154843796) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone.

Molecular Properties

Compound Name[2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
PubChem CID154843796
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name[2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
SMILESO=C(c1cccn2nnnc12)N1CCCCC1CC1CCC1
InChIInChI=1S/C16H21N5O/c22-16(14-8-4-10-21-15(14)17-18-19-21)20-9-2-1-7-13(20)11-12-5-3-6-12/h4,8,10,12-13H,1-3,5-7,9,11H2
InChIKeyVNMZBINOIPEICH-UHFFFAOYSA-N
XLogP2.31
TPSA63.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[2-(3-methoxyphenyl)ethyl]piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
CID 46977921
3-[(2R)-2-(aminomethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 125134550
[2-(2-chloroethyl)piperidin-1-yl]-(2-chlorophenyl)methanone
CID 63394055
(2-ethylazepan-1-yl)-(2-hydroxyphenyl)methanone
CID 112692526
[2-(chloromethyl)pyrrolidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103122402
1-[1-(2-fluorobenzoyl)piperidin-2-yl]propan-2-one
CID 79549037
1-[(2R)-2-(cyclohexylmethyl)pyrrolidin-1-yl]-2-([1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethanone
CID 94885492
N-carbamoyl-2-[2-[(2R)-2-(2-hydroxyethyl)piperidine-1-carbonyl]anilino]acetamide
CID 95636491
[2-(2-hydroxyethyl)piperidin-1-yl]-[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methanone
CID 84576187
4-[2-(cyclohexylmethyl)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one
CID 71935198
2,3-dihydro-1,4-benzodioxin-5-yl-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 60955013
[(2R)-2-(aminomethyl)piperidin-1-yl]-(1,3-benzodioxol-4-yl)methanone
CID 124573517

Frequently Asked Questions

What is the IUPAC name of [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The IUPAC name of [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone (CID 154843796) is [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone.
What is the SMILES notation for [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The canonical SMILES for [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone is O=C(c1cccn2nnnc12)N1CCCCC1CC1CCC1.
What is the InChIKey of [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The InChIKey is VNMZBINOIPEICH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O/c22-16(14-8-4-10-21-15(14)17-18-19-21)20-9-2-1-7-13(20)11-12-5-3-6-12/h4,8,10,12-13H,1-3,5-7,9,11H2.
What are the key properties of [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
[2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone has a molecular weight of 299.38 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclobutylmethyl)piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone is sourced from PubChem (CID 154843796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).