3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide

C11H17N7O — CID 91780176

IUPAC3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide
SMILESCc1nnnn1CCC(=O)NC(C)Cn1cccn1
InChIInChI=1S/C11H17N7O/c1-9(8-17-6-3-5-12-17)13-11(19)4-7-18-10(2)14-15-16-18/h3,5-6,9H,4,7-8H2,1-2H3,(H,13,19)
InChIKeyOHPYFGQBFUHVFV-UHFFFAOYSA-N
MW263.31 g/mol
LogP-0.23
Rot. Bonds6

About 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide

3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide (PubChem CID 91780176) has the molecular formula C11H17N7O and a molecular weight of 263.31 g/mol. Its IUPAC name is 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide.

Molecular Properties

Compound Name3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide
PubChem CID91780176
Molecular FormulaC11H17N7O
Molecular Weight263.31 g/mol
Exact Mass263.15
IUPAC Name3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide
SMILESCc1nnnn1CCC(=O)NC(C)Cn1cccn1
InChIInChI=1S/C11H17N7O/c1-9(8-17-6-3-5-12-17)13-11(19)4-7-18-10(2)14-15-16-18/h3,5-6,9H,4,7-8H2,1-2H3,(H,13,19)
InChIKeyOHPYFGQBFUHVFV-UHFFFAOYSA-N
XLogP-0.23
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide?
The IUPAC name of 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide (CID 91780176) is 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide.
What is the SMILES notation for 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide?
The canonical SMILES for 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide is Cc1nnnn1CCC(=O)NC(C)Cn1cccn1.
What is the InChIKey of 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide?
The InChIKey is OHPYFGQBFUHVFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7O/c1-9(8-17-6-3-5-12-17)13-11(19)4-7-18-10(2)14-15-16-18/h3,5-6,9H,4,7-8H2,1-2H3,(H,13,19).
What are the key properties of 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide?
3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide has a molecular weight of 263.31 g/mol, XLogP of -0.23, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyltetrazol-1-yl)-N-(1-pyrazol-1-ylpropan-2-yl)propanamide is sourced from PubChem (CID 91780176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).