3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide

C19H25N3O2 — CID 22852184

IUPAC3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide
SMILESCN1C2CCCC1[C@@H](NC(=O)N1C(=O)C(C)(C)c3ccccc31)C2
InChIInChI=1S/C19H25N3O2/c1-19(2)13-8-4-5-9-15(13)22(17(19)23)18(24)20-14-11-12-7-6-10-16(14)21(12)3/h4-5,8-9,12,14,16H,6-7,10-11H2,1-3H3,(H,20,24)/t12?,14-,16?/m0/s1
InChIKeyNPWKAEHLNVWAIQ-UGWHAMFMSA-N
MW327.43 g/mol
LogP2.65
Rot. Bonds1

About 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide

3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide (PubChem CID 22852184) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide.

Molecular Properties

Compound Name3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide
PubChem CID22852184
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide
SMILESCN1C2CCCC1[C@@H](NC(=O)N1C(=O)C(C)(C)c3ccccc31)C2
InChIInChI=1S/C19H25N3O2/c1-19(2)13-8-4-5-9-15(13)22(17(19)23)18(24)20-14-11-12-7-6-10-16(14)21(12)3/h4-5,8-9,12,14,16H,6-7,10-11H2,1-3H3,(H,20,24)/t12?,14-,16?/m0/s1
InChIKeyNPWKAEHLNVWAIQ-UGWHAMFMSA-N
XLogP2.65
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide with MolForge

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Related Compounds

3,3-dimethyl-2-oxo-N-[[(1S)-5,6,7,8-tetrahydro-1H-pyrrolizin-1-yl]methyl]indole-1-carboxamide
CID 22852186
N-[(4R)-1-azatricyclo[3.3.1.03,7]nonan-4-yl]-3,3-dimethyl-2-oxoindole-1-carboxamide
CID 54040962
N-[(4-hydroxypiperidin-4-yl)methyl]-3,3-dimethyl-2-oxoindole-1-carboxamide
CID 67233261
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-2,3-dihydroindole-1-carboxamide
CID 14809231
methyl 9-methyl-3-phenyl-9-azabicyclo[3.3.1]nonane-2-carboxylate
CID 18756318
3,3-dimethyl-1-(3-oxocyclohexyl)indol-2-one
CID 141035211
1'-acetyl-2'-oxospiro[1,2,5,6,7,8-hexahydropyrrolizine-3,3'-indole]-2-carboxylic acid
CID 53212917
1-(2-fluorophenyl)-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)cyclopropane-1-carboxamide
CID 75374478
N-cyclopentyl-1'-methyl-2'-oxospiro[1,2,5,6,7,8-hexahydropyrrolizine-3,3'-indole]-2-carboxamide
CID 126459729
N-butan-2-yl-1'-methyl-2'-oxospiro[1,2,5,6,7,8-hexahydropyrrolizine-3,3'-indole]-2-carboxamide
CID 126459734
N-cyclohexyl-2-(1,3,3-trimethylindol-2-ylidene)acetamide
CID 4656730
2-chloro-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-phenylacetamide
CID 65471032

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide?
The IUPAC name of 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide (CID 22852184) is 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide.
What is the SMILES notation for 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide?
The canonical SMILES for 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide is CN1C2CCCC1[C@@H](NC(=O)N1C(=O)C(C)(C)c3ccccc31)C2.
What is the InChIKey of 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide?
The InChIKey is NPWKAEHLNVWAIQ-UGWHAMFMSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-19(2)13-8-4-5-9-15(13)22(17(19)23)18(24)20-14-11-12-7-6-10-16(14)21(12)3/h4-5,8-9,12,14,16H,6-7,10-11H2,1-3H3,(H,20,24)/t12?,14-,16?/m0/s1.
What are the key properties of 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide?
3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-[(6S)-8-methyl-8-azabicyclo[3.2.1]octan-6-yl]-2-oxoindole-1-carboxamide is sourced from PubChem (CID 22852184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).