N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide

C9H16N6O — CID 43602134

IUPACN-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide
SMILESCN(C(=O)Cn1cnnn1)C1CCNCC1
InChIInChI=1S/C9H16N6O/c1-14(8-2-4-10-5-3-8)9(16)6-15-7-11-12-13-15/h7-8,10H,2-6H2,1H3
InChIKeyHGGQJJHQBFAHJE-UHFFFAOYSA-N
MW224.27 g/mol
LogP-1.12
Rot. Bonds3

About N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide

N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide (PubChem CID 43602134) has the molecular formula C9H16N6O and a molecular weight of 224.27 g/mol. Its IUPAC name is N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide
PubChem CID43602134
Molecular FormulaC9H16N6O
Molecular Weight224.27 g/mol
Exact Mass224.14
IUPAC NameN-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide
SMILESCN(C(=O)Cn1cnnn1)C1CCNCC1
InChIInChI=1S/C9H16N6O/c1-14(8-2-4-10-5-3-8)9(16)6-15-7-11-12-13-15/h7-8,10H,2-6H2,1H3
InChIKeyHGGQJJHQBFAHJE-UHFFFAOYSA-N
XLogP-1.12
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 5-1.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide?
The IUPAC name of N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide (CID 43602134) is N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide.
What is the SMILES notation for N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide?
The canonical SMILES for N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide is CN(C(=O)Cn1cnnn1)C1CCNCC1.
What is the InChIKey of N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide?
The InChIKey is HGGQJJHQBFAHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6O/c1-14(8-2-4-10-5-3-8)9(16)6-15-7-11-12-13-15/h7-8,10H,2-6H2,1H3.
What are the key properties of N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide?
N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide has a molecular weight of 224.27 g/mol, XLogP of -1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-piperidin-4-yl-2-(tetrazol-1-yl)acetamide is sourced from PubChem (CID 43602134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).