N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium

C17H24N4OV — CID 159657353

IUPACN-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium
SMILESCC(C)n1nc(C(=O)NCC2CCNCC2)c2ccccc21.[V]
InChIInChI=1S/C17H24N4O.V/c1-12(2)21-15-6-4-3-5-14(15)16(20-21)17(22)19-11-13-7-9-18-10-8-13;/h3-6,12-13,18H,7-11H2,1-2H3,(H,19,22);
InChIKeyMSIOOMCRVFVKOS-UHFFFAOYSA-N
MW351.35 g/mol
LogP2.34
Rot. Bonds4

About N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium

N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium (PubChem CID 159657353) has the molecular formula C17H24N4OV and a molecular weight of 351.35 g/mol. Its IUPAC name is N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium.

Molecular Properties

Compound NameN-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium
PubChem CID159657353
Molecular FormulaC17H24N4OV
Molecular Weight351.35 g/mol
Exact Mass351.14
IUPAC NameN-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium
SMILESCC(C)n1nc(C(=O)NCC2CCNCC2)c2ccccc21.[V]
InChIInChI=1S/C17H24N4O.V/c1-12(2)21-15-6-4-3-5-14(15)16(20-21)17(22)19-11-13-7-9-18-10-8-13;/h3-6,12-13,18H,7-11H2,1-2H3,(H,19,22);
InChIKeyMSIOOMCRVFVKOS-UHFFFAOYSA-N
XLogP2.34
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.35
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium 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 N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium?
The IUPAC name of N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium (CID 159657353) is N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium.
What is the SMILES notation for N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium?
The canonical SMILES for N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium is CC(C)n1nc(C(=O)NCC2CCNCC2)c2ccccc21.[V].
What is the InChIKey of N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium?
The InChIKey is MSIOOMCRVFVKOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O.V/c1-12(2)21-15-6-4-3-5-14(15)16(20-21)17(22)19-11-13-7-9-18-10-8-13;/h3-6,12-13,18H,7-11H2,1-2H3,(H,19,22);.
What are the key properties of N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium?
N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium has a molecular weight of 351.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylmethyl)-1-propan-2-ylindazole-3-carboxamide;vanadium is sourced from PubChem (CID 159657353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).