4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide

C19H25N7O2 — CID 1267908

IUPAC4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide
SMILESNC(=O)C1(N2CCCCC2)CCN(C(=O)c2ccc(-n3cnnn3)cc2)CC1
InChIInChI=1S/C19H25N7O2/c20-18(28)19(25-10-2-1-3-11-25)8-12-24(13-9-19)17(27)15-4-6-16(7-5-15)26-14-21-22-23-26/h4-7,14H,1-3,8-13H2,(H2,20,28)
InChIKeyXGUIIADGINTIHJ-UHFFFAOYSA-N
MW383.46 g/mol
LogP0.61
Rot. Bonds4

About 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide

4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide (PubChem CID 1267908) has the molecular formula C19H25N7O2 and a molecular weight of 383.46 g/mol. Its IUPAC name is 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide
PubChem CID1267908
Molecular FormulaC19H25N7O2
Molecular Weight383.46 g/mol
Exact Mass383.21
IUPAC Name4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide
SMILESNC(=O)C1(N2CCCCC2)CCN(C(=O)c2ccc(-n3cnnn3)cc2)CC1
InChIInChI=1S/C19H25N7O2/c20-18(28)19(25-10-2-1-3-11-25)8-12-24(13-9-19)17(27)15-4-6-16(7-5-15)26-14-21-22-23-26/h4-7,14H,1-3,8-13H2,(H2,20,28)
InChIKeyXGUIIADGINTIHJ-UHFFFAOYSA-N
XLogP0.61
TPSA110.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.46
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide?
The IUPAC name of 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide (CID 1267908) is 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide?
The canonical SMILES for 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide is NC(=O)C1(N2CCCCC2)CCN(C(=O)c2ccc(-n3cnnn3)cc2)CC1.
What is the InChIKey of 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide?
The InChIKey is XGUIIADGINTIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7O2/c20-18(28)19(25-10-2-1-3-11-25)8-12-24(13-9-19)17(27)15-4-6-16(7-5-15)26-14-21-22-23-26/h4-7,14H,1-3,8-13H2,(H2,20,28).
What are the key properties of 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide?
4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide has a molecular weight of 383.46 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-yl-1-[4-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide is sourced from PubChem (CID 1267908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).