N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide

C19H19N5O2 — CID 137456634

IUPACN-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide
SMILESO=C(NC1CCN(NC(=O)c2ccccc2)C1)c1ccc2cn[nH]c2c1
InChIInChI=1S/C19H19N5O2/c25-18(14-6-7-15-11-20-22-17(15)10-14)21-16-8-9-24(12-16)23-19(26)13-4-2-1-3-5-13/h1-7,10-11,16H,8-9,12H2,(H,20,22)(H,21,25)(H,23,26)
InChIKeyRXMHJOAPGZSZJU-UHFFFAOYSA-N
MW349.39 g/mol
LogP1.71
Rot. Bonds4

About N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide

N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide (PubChem CID 137456634) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide
PubChem CID137456634
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC NameN-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide
SMILESO=C(NC1CCN(NC(=O)c2ccccc2)C1)c1ccc2cn[nH]c2c1
InChIInChI=1S/C19H19N5O2/c25-18(14-6-7-15-11-20-22-17(15)10-14)21-16-8-9-24(12-16)23-19(26)13-4-2-1-3-5-13/h1-7,10-11,16H,8-9,12H2,(H,20,22)(H,21,25)(H,23,26)
InChIKeyRXMHJOAPGZSZJU-UHFFFAOYSA-N
XLogP1.71
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-methylpiperidin-4-yl)-1H-indazole-6-carboxamide
CID 62905083
N-(1-methylpiperidin-3-yl)-1H-indazole-6-carboxamide
CID 55133135
N-[(3R)-1-azabicyclo[5.2.0]nonan-3-yl]-1H-indazole-6-carboxamide
CID 67562654
N-(1-propylpiperidin-4-yl)-1H-indazole-6-carboxamide
CID 60715287
N-(1-methyl-6-oxopiperidin-3-yl)-1H-indazole-6-carboxamide
CID 64667250
N-morpholin-4-yl-1H-indazole-6-carboxamide
CID 78974867
3-(1H-indazole-6-carbonylamino)cyclohexane-1-carboxylic acid
CID 63043468
N-(5-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide
CID 114156980
N-(2,6-dimethylpiperidin-1-yl)-1H-indazole-6-carboxamide
CID 83023464
N-(1-methyl-2-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide
CID 106256433
N-(4-anilinopiperidin-1-yl)benzamide
CID 175169072
N-(1-methylazepan-3-yl)-1H-indazole-5-carboxamide
CID 22933430

Frequently Asked Questions

What is the IUPAC name of N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide (CID 137456634) is N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide is O=C(NC1CCN(NC(=O)c2ccccc2)C1)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
The InChIKey is RXMHJOAPGZSZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c25-18(14-6-7-15-11-20-22-17(15)10-14)21-16-8-9-24(12-16)23-19(26)13-4-2-1-3-5-13/h1-7,10-11,16H,8-9,12H2,(H,20,22)(H,21,25)(H,23,26).
What are the key properties of N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide?
N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 1.71, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzamidopyrrolidin-3-yl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 137456634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).