(3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide

C13H16N4O — CID 81124265

IUPAC(3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)[C@@H]1CCCNC1
InChIInChI=1S/C13H16N4O/c18-13(10-2-1-5-14-7-10)16-11-4-3-9-8-15-17-12(9)6-11/h3-4,6,8,10,14H,1-2,5,7H2,(H,15,17)(H,16,18)/t10-/m1/s1
InChIKeyVQINWTHBYZUUIB-SNVBAGLBSA-N
MW244.30 g/mol
LogP1.50
Rot. Bonds2

About (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide

(3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide (PubChem CID 81124265) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide
PubChem CID81124265
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name(3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)[C@@H]1CCCNC1
InChIInChI=1S/C13H16N4O/c18-13(10-2-1-5-14-7-10)16-11-4-3-9-8-15-17-12(9)6-11/h3-4,6,8,10,14H,1-2,5,7H2,(H,15,17)(H,16,18)/t10-/m1/s1
InChIKeyVQINWTHBYZUUIB-SNVBAGLBSA-N
XLogP1.50
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide (CID 81124265) is (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide is O=C(Nc1ccc2cn[nH]c2c1)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide?
The InChIKey is VQINWTHBYZUUIB-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16N4O/c18-13(10-2-1-5-14-7-10)16-11-4-3-9-8-15-17-12(9)6-11/h3-4,6,8,10,14H,1-2,5,7H2,(H,15,17)(H,16,18)/t10-/m1/s1.
What are the key properties of (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide?
(3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide has a molecular weight of 244.30 g/mol, XLogP of 1.50, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(1H-indazol-6-yl)piperidine-3-carboxamide is sourced from PubChem (CID 81124265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).