(2-methyltetrazol-5-yl)-piperidin-2-ylmethanone

C8H13N5O — CID 130877919

IUPAC(2-methyltetrazol-5-yl)-piperidin-2-ylmethanone
SMILESCn1nnc(C(=O)C2CCCCN2)n1
InChIInChI=1S/C8H13N5O/c1-13-11-8(10-12-13)7(14)6-4-2-3-5-9-6/h6,9H,2-5H2,1H3
InChIKeyHNBOJINKSDBYLK-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.47
Rot. Bonds2

About (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone

(2-methyltetrazol-5-yl)-piperidin-2-ylmethanone (PubChem CID 130877919) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone.

Molecular Properties

Compound Name(2-methyltetrazol-5-yl)-piperidin-2-ylmethanone
PubChem CID130877919
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name(2-methyltetrazol-5-yl)-piperidin-2-ylmethanone
SMILESCn1nnc(C(=O)C2CCCCN2)n1
InChIInChI=1S/C8H13N5O/c1-13-11-8(10-12-13)7(14)6-4-2-3-5-9-6/h6,9H,2-5H2,1H3
InChIKeyHNBOJINKSDBYLK-UHFFFAOYSA-N
XLogP-0.47
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-Methyltetrazol-5-yl)-1-pyrrolidin-2-ylethanone
CID 107061719
2-(2-Methyltetrazol-5-yl)-1-piperidin-2-ylethanone
CID 107061727
2-(2-Methyltetrazol-5-yl)-1-(1-piperidin-4-ylpyrrolidin-2-yl)ethanone
CID 107061880
1-(2-Methyltetrazol-5-yl)-4-piperidin-2-ylbutan-2-one
CID 107061943
1-(4-Aminopiperidin-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-one
CID 107062291
1-(2-Methylpiperidin-2-yl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107062542
1-(2-Methyltetrazol-5-yl)-2-piperidin-4-ylethanone
CID 130758299
(2-Methylpiperidin-2-yl)-(2-methyltetrazol-5-yl)methanone
CID 130847652
(6-Methylpiperidin-3-yl)-(2-methyltetrazol-5-yl)methanone
CID 130951961
Azepan-2-yl-(2-methyltetrazol-5-yl)methanone
CID 130993638

Frequently Asked Questions

What is the IUPAC name of (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone?
The IUPAC name of (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone (CID 130877919) is (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone.
What is the SMILES notation for (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone?
The canonical SMILES for (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone is Cn1nnc(C(=O)C2CCCCN2)n1.
What is the InChIKey of (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone?
The InChIKey is HNBOJINKSDBYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c1-13-11-8(10-12-13)7(14)6-4-2-3-5-9-6/h6,9H,2-5H2,1H3.
What are the key properties of (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone?
(2-methyltetrazol-5-yl)-piperidin-2-ylmethanone has a molecular weight of 195.23 g/mol, XLogP of -0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyltetrazol-5-yl)-piperidin-2-ylmethanone is sourced from PubChem (CID 130877919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).