(5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone

C9H15N5O — CID 130913870

IUPAC(5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone
SMILESCC1CNCC(C(=O)c2nnn(C)n2)C1
InChIInChI=1S/C9H15N5O/c1-6-3-7(5-10-4-6)8(15)9-11-13-14(2)12-9/h6-7,10H,3-5H2,1-2H3
InChIKeyGXXFUXUUPSJHMI-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.36
Rot. Bonds2

About (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone

(5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone (PubChem CID 130913870) has the molecular formula C9H15N5O and a molecular weight of 209.25 g/mol. Its IUPAC name is (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone.

Molecular Properties

Compound Name(5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone
PubChem CID130913870
Molecular FormulaC9H15N5O
Molecular Weight209.25 g/mol
Exact Mass209.13
IUPAC Name(5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone
SMILESCC1CNCC(C(=O)c2nnn(C)n2)C1
InChIInChI=1S/C9H15N5O/c1-6-3-7(5-10-4-6)8(15)9-11-13-14(2)12-9/h6-7,10H,3-5H2,1-2H3
InChIKeyGXXFUXUUPSJHMI-UHFFFAOYSA-N
XLogP-0.36
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[(2-Methyltetrazol-5-yl)methyl]piperidin-4-one
CID 107044552
2-[(2-Methyltetrazol-5-yl)methyl]piperidine-3-carboxamide
CID 107054758
3-[(2-Methyltetrazol-5-yl)methyl]piperidin-2-one
CID 107061686
2-(2-Methyltetrazol-5-yl)-1-piperidin-4-ylethanone
CID 107061723
2-(2-Methyltetrazol-5-yl)-1-piperidin-3-ylethanone
CID 107061730
1-(2-Methyltetrazol-5-yl)-3-piperidin-4-ylpropan-2-one
CID 107061884
1-(2-Methyltetrazol-5-yl)-4-piperidin-3-ylbutan-2-one
CID 107061925
1-(2-Methyltetrazol-5-yl)-4-piperidin-4-ylbutan-2-one
CID 107061940
1-(2-Methyltetrazol-5-yl)-3-piperidin-3-ylpropan-2-one
CID 107061949
1-(4-Methylpiperidin-4-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107061990
1-(4-Ethylpiperidin-4-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107061997
2-(2-Methyltetrazol-5-yl)-1-pyrrolidin-3-ylethanone
CID 107062001

Frequently Asked Questions

What is the IUPAC name of (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone?
The IUPAC name of (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone (CID 130913870) is (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone.
What is the SMILES notation for (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone?
The canonical SMILES for (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone is CC1CNCC(C(=O)c2nnn(C)n2)C1.
What is the InChIKey of (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone?
The InChIKey is GXXFUXUUPSJHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O/c1-6-3-7(5-10-4-6)8(15)9-11-13-14(2)12-9/h6-7,10H,3-5H2,1-2H3.
What are the key properties of (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone?
(5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone has a molecular weight of 209.25 g/mol, XLogP of -0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone is sourced from PubChem (CID 130913870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).