2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride

C17H22ClN3O2 — CID 119709216

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride
SMILESCl.O=C(CC1CC2CCC(C1)N2)Nc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C17H21N3O2.ClH/c21-16(7-10-5-12-1-2-13(6-10)18-12)19-14-3-4-15-11(8-14)9-17(22)20-15;/h3-4,8,10,12-13,18H,1-2,5-7,9H2,(H,19,21)(H,20,22);1H
InChIKeyAVJKRYFNVHLOHC-UHFFFAOYSA-N
MW335.84 g/mol
LogP2.46
Rot. Bonds3

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride (PubChem CID 119709216) has the molecular formula C17H22ClN3O2 and a molecular weight of 335.84 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride
PubChem CID119709216
Molecular FormulaC17H22ClN3O2
Molecular Weight335.84 g/mol
Exact Mass335.14
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride
SMILESCl.O=C(CC1CC2CCC(C1)N2)Nc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C17H21N3O2.ClH/c21-16(7-10-5-12-1-2-13(6-10)18-12)19-14-3-4-15-11(8-14)9-17(22)20-15;/h3-4,8,10,12-13,18H,1-2,5-7,9H2,(H,19,21)(H,20,22);1H
InChIKeyAVJKRYFNVHLOHC-UHFFFAOYSA-N
XLogP2.46
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.84
LogP ≤ 52.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride with MolForge

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Related Compounds

3-cyclopentyl-N-(2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 18570800
N-[4-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]phenyl]propanamide;hydrochloride
CID 119735821
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1,3-benzodioxol-5-yl)acetamide;hydrochloride
CID 119668960
5-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]-2-chlorobenzamide;hydrochloride
CID 119711582
4-amino-N-(2-oxo-1,3-dihydroindol-5-yl)butanamide
CID 22690108
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1,3-benzothiazol-6-yl)acetamide;hydrochloride
CID 119734492
N-(3-acetamido-4-methylphenyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 119711365
N-(3-acetylphenyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide;hydrochloride
CID 119673318
N-[4-[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]phenyl]-3-(dimethylamino)propanamide;dihydrochloride
CID 119868270
N-(3-acetamido-4-fluorophenyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide;hydrochloride
CID 119702837
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 119672808
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[4-methyl-3-(trifluoromethyl)phenyl]acetamide
CID 119697637

Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride (CID 119709216) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride is Cl.O=C(CC1CC2CCC(C1)N2)Nc1ccc2c(c1)CC(=O)N2.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride?
The InChIKey is AVJKRYFNVHLOHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2.ClH/c21-16(7-10-5-12-1-2-13(6-10)18-12)19-14-3-4-15-11(8-14)9-17(22)20-15;/h3-4,8,10,12-13,18H,1-2,5-7,9H2,(H,19,21)(H,20,22);1H.
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride?
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride has a molecular weight of 335.84 g/mol, XLogP of 2.46, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)acetamide;hydrochloride is sourced from PubChem (CID 119709216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).