7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide

C20H23N3O2 — CID 132583260

IUPAC7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide
SMILESCC(C)(C)NC(=O)N1CCc2cccc(NC(=O)c3ccccc3)c21
InChIInChI=1S/C20H23N3O2/c1-20(2,3)22-19(25)23-13-12-14-10-7-11-16(17(14)23)21-18(24)15-8-5-4-6-9-15/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyJRMQAZQOUSJODL-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.81
Rot. Bonds2

About 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide

7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide (PubChem CID 132583260) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide
PubChem CID132583260
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide
SMILESCC(C)(C)NC(=O)N1CCc2cccc(NC(=O)c3ccccc3)c21
InChIInChI=1S/C20H23N3O2/c1-20(2,3)22-19(25)23-13-12-14-10-7-11-16(17(14)23)21-18(24)15-8-5-4-6-9-15/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyJRMQAZQOUSJODL-UHFFFAOYSA-N
XLogP3.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-acetyl-2,3-dihydroindol-7-yl)-4-bromobenzamide
CID 112537123
N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide
CID 112537232
4-methyl-N-(1-pyrimidin-2-yl-2,3-dihydroindol-7-yl)benzamide
CID 142743601
tert-butyl 7-[(2-cyanoacetyl)amino]-2,3-dihydroindole-1-carboxylate
CID 168520980
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methylpropanamide
CID 112537152
N-tert-butyl-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 2942390
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 166234118
N-(3-chloro-2-piperidin-1-ylphenyl)benzamide
CID 952564
N-tert-butyl-3-(3,4-dihydro-2H-quinoline-1-carbonyl)benzamide
CID 109055995
N-[1-[4-(dimethylamino)benzoyl]-2,3-dihydroindol-7-yl]acetamide
CID 112537299
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
CID 112537144
N-(1,2,3,4-tetrahydroisoquinolin-8-yl)benzamide
CID 70303028

Frequently Asked Questions

What is the IUPAC name of 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide (CID 132583260) is 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide is CC(C)(C)NC(=O)N1CCc2cccc(NC(=O)c3ccccc3)c21.
What is the InChIKey of 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide?
The InChIKey is JRMQAZQOUSJODL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-20(2,3)22-19(25)23-13-12-14-10-7-11-16(17(14)23)21-18(24)15-8-5-4-6-9-15/h4-11H,12-13H2,1-3H3,(H,21,24)(H,22,25).
What are the key properties of 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide?
7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 3.81, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 132583260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).