N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide

C14H18N4O — CID 62905083

IUPACN-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide
SMILESCN1CCC(NC(=O)c2ccc3cn[nH]c3c2)CC1
InChIInChI=1S/C14H18N4O/c1-18-6-4-12(5-7-18)16-14(19)10-2-3-11-9-15-17-13(11)8-10/h2-3,8-9,12H,4-7H2,1H3,(H,15,17)(H,16,19)
InChIKeyVLRWLRUDFIXFLP-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.39
Rot. Bonds2

About N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide

N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide (PubChem CID 62905083) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide
PubChem CID62905083
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide
SMILESCN1CCC(NC(=O)c2ccc3cn[nH]c3c2)CC1
InChIInChI=1S/C14H18N4O/c1-18-6-4-12(5-7-18)16-14(19)10-2-3-11-9-15-17-13(11)8-10/h2-3,8-9,12H,4-7H2,1H3,(H,15,17)(H,16,19)
InChIKeyVLRWLRUDFIXFLP-UHFFFAOYSA-N
XLogP1.39
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide (CID 62905083) is N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide is CN1CCC(NC(=O)c2ccc3cn[nH]c3c2)CC1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide?
The InChIKey is VLRWLRUDFIXFLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-18-6-4-12(5-7-18)16-14(19)10-2-3-11-9-15-17-13(11)8-10/h2-3,8-9,12H,4-7H2,1H3,(H,15,17)(H,16,19).
What are the key properties of N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide?
N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 62905083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).