4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide

C11H20N6O — CID 107054781

IUPAC4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCC1CC(C)C(C(N)=O)C(Cc2nnn(C)n2)N1
InChIInChI=1S/C11H20N6O/c1-6-4-7(2)13-8(10(6)11(12)18)5-9-14-16-17(3)15-9/h6-8,10,13H,4-5H2,1-3H3,(H2,12,18)
InChIKeyTUVXWLWWGYVKCX-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.76
Rot. Bonds3

About 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide

4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide (PubChem CID 107054781) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide
PubChem CID107054781
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCC1CC(C)C(C(N)=O)C(Cc2nnn(C)n2)N1
InChIInChI=1S/C11H20N6O/c1-6-4-7(2)13-8(10(6)11(12)18)5-9-14-16-17(3)15-9/h6-8,10,13H,4-5H2,1-3H3,(H2,12,18)
InChIKeyTUVXWLWWGYVKCX-UHFFFAOYSA-N
XLogP-0.76
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2-Methyltetrazol-5-yl)methyl]piperidine-3-carboxamide
CID 107054758
N,N-dimethyl-4-[(2-methyltetrazol-5-yl)methyl]piperidine-2-carboxamide
CID 107054765
N-methyl-4-[(2-methyltetrazol-5-yl)methyl]piperidine-2-carboxamide
CID 107054766
4-[(2-Methyltetrazol-5-yl)methyl]piperidine-2-carboxamide
CID 107054782
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-(6-Azaspiro[2.5]octan-2-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107062061
1-(2-Methyltetrazol-5-yl)-4-piperidin-3-ylpentan-2-one
CID 107062305
1-(2-Methylpiperidin-2-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107062542

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide (CID 107054781) is 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide is CC1CC(C)C(C(N)=O)C(Cc2nnn(C)n2)N1.
What is the InChIKey of 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide?
The InChIKey is TUVXWLWWGYVKCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-6-4-7(2)13-8(10(6)11(12)18)5-9-14-16-17(3)15-9/h6-8,10,13H,4-5H2,1-3H3,(H2,12,18).
What are the key properties of 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide?
4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide has a molecular weight of 252.32 g/mol, XLogP of -0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-[(2-methyltetrazol-5-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 107054781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).