2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide

C22H23N5O — CID 176503598

IUPAC2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide
SMILESO=C(Cc1[nH]nc2ccccc12)NC1CCC(n2cccc3ccnc2-3)CC1
InChIInChI=1S/C22H23N5O/c28-21(14-20-18-5-1-2-6-19(18)25-26-20)24-16-7-9-17(10-8-16)27-13-3-4-15-11-12-23-22(15)27/h1-6,11-13,16-17H,7-10,14H2,(H,24,28)(H,25,26)
InChIKeyMUBXARJLBSQQAH-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.71
Rot. Bonds4

About 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide

2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide (PubChem CID 176503598) has the molecular formula C22H23N5O and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide
PubChem CID176503598
Molecular FormulaC22H23N5O
Molecular Weight373.46 g/mol
Exact Mass373.19
IUPAC Name2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide
SMILESO=C(Cc1[nH]nc2ccccc12)NC1CCC(n2cccc3ccnc2-3)CC1
InChIInChI=1S/C22H23N5O/c28-21(14-20-18-5-1-2-6-19(18)25-26-20)24-16-7-9-17(10-8-16)27-13-3-4-15-11-12-23-22(15)27/h1-6,11-13,16-17H,7-10,14H2,(H,24,28)(H,25,26)
InChIKeyMUBXARJLBSQQAH-UHFFFAOYSA-N
XLogP3.71
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)-2H-benzotriazole-5-carboxamide
CID 175645409
2,3-dimethyl-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)quinoxaline-6-carboxamide
CID 176502051
2-(2H-indazol-3-yl)-N-(2-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120601030
N-(1-cyclohexyl-1,2,4-triazol-3-yl)-2-(2H-indazol-3-yl)acetamide
CID 154735944
2-(2H-indazol-3-yl)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 118772312
N-(2-aminoethyl)-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 119384110
1-(4-aminopiperidin-1-yl)-2-(2H-indazol-3-yl)ethanone
CID 119375250
N-[(3R)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidin-3-yl]-2-(2H-indazol-3-yl)acetamide
CID 42465722
N-(2-amino-1-cyclohexylethyl)-2-(2H-indazol-3-yl)acetamide
CID 119590893
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 119574460
1-[2-(2H-indazol-3-yl)acetyl]piperidine-4-carboxylic acid
CID 119166712
1-[4-(cyclopropylmethylamino)piperidin-1-yl]-2-(2H-indazol-3-yl)ethanone;hydrochloride
CID 119623896

Frequently Asked Questions

What is the IUPAC name of 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide?
The IUPAC name of 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide (CID 176503598) is 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide.
What is the SMILES notation for 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide?
The canonical SMILES for 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide is O=C(Cc1[nH]nc2ccccc12)NC1CCC(n2cccc3ccnc2-3)CC1.
What is the InChIKey of 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide?
The InChIKey is MUBXARJLBSQQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O/c28-21(14-20-18-5-1-2-6-19(18)25-26-20)24-16-7-9-17(10-8-16)27-13-3-4-15-11-12-23-22(15)27/h1-6,11-13,16-17H,7-10,14H2,(H,24,28)(H,25,26).
What are the key properties of 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide?
2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide has a molecular weight of 373.46 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-indazol-3-yl)-N-(4-pyrrolo[2,3-b]pyridin-7-ylcyclohexyl)acetamide is sourced from PubChem (CID 176503598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).