2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid

C10H15N5O3 — CID 113430628

IUPAC2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid
SMILESCC1(C(=O)O)CCCCN1C(=O)Cn1cnnn1
InChIInChI=1S/C10H15N5O3/c1-10(9(17)18)4-2-3-5-15(10)8(16)6-14-7-11-12-13-14/h7H,2-6H2,1H3,(H,17,18)
InChIKeyFIMVWOSKKZMMPQ-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.47
Rot. Bonds3

About 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid

2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid (PubChem CID 113430628) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid.

Molecular Properties

Compound Name2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid
PubChem CID113430628
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid
SMILESCC1(C(=O)O)CCCCN1C(=O)Cn1cnnn1
InChIInChI=1S/C10H15N5O3/c1-10(9(17)18)4-2-3-5-15(10)8(16)6-14-7-11-12-13-14/h7H,2-6H2,1H3,(H,17,18)
InChIKeyFIMVWOSKKZMMPQ-UHFFFAOYSA-N
XLogP-0.47
TPSA101.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-ethyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-3-carboxylic acid
CID 63134611
1-[2-methyl-2-[(3,4,5-trifluorophenyl)methyl]pyrrolidin-1-yl]-2-(tetrazol-1-yl)ethanone
CID 146137952
1-[ethyl(propan-2-yl)carbamoyl]-2-methylpiperidine-2-carboxylic acid
CID 104597887
1-(2,2-dimethylbutanoyl)-2-methylpiperidine-2-carboxylic acid
CID 104594792
1-[(1R)-1-methyl-1-(trifluoromethyl)-3,4-dihydroisoquinolin-2-yl]-2-(tetrazol-1-yl)ethanone
CID 124853377
1-(5,5-dimethylhexanoyl)-2-methylpiperidine-2-carboxylic acid
CID 115270714
2-methyl-1-[3-(propan-2-ylamino)propanoyl]piperidine-2-carboxylic acid
CID 113430915
1-(5-aminopentanoyl)-2-methylpiperidine-2-carboxylic acid
CID 113430942
4-phenyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-4-carboxylic acid
CID 119164517
1-(3,4-dihydroxypyrrolidine-1-carbonyl)-2-methylpiperidine-2-carboxylic acid
CID 106670570
2-methyl-1-[2-(1H-pyrazol-5-yl)acetyl]piperidine-2-carboxylic acid
CID 104594818
2-methyl-1-(2-methylbutan-2-ylcarbamoyl)piperidine-2-carboxylic acid
CID 104597770

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid?
The IUPAC name of 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid (CID 113430628) is 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid.
What is the SMILES notation for 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid?
The canonical SMILES for 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid is CC1(C(=O)O)CCCCN1C(=O)Cn1cnnn1.
What is the InChIKey of 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid?
The InChIKey is FIMVWOSKKZMMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c1-10(9(17)18)4-2-3-5-15(10)8(16)6-14-7-11-12-13-14/h7H,2-6H2,1H3,(H,17,18).
What are the key properties of 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid?
2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of -0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[2-(tetrazol-1-yl)acetyl]piperidine-2-carboxylic acid is sourced from PubChem (CID 113430628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).