N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide

C22H20N2O — CID 108991209

IUPACN-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide
SMILESO=C(N(Cc1ccccc1)c1ccccc1)N1CCc2ccccc21
InChIInChI=1S/C22H20N2O/c25-22(23-16-15-19-11-7-8-14-21(19)23)24(20-12-5-2-6-13-20)17-18-9-3-1-4-10-18/h1-14H,15-17H2
InChIKeyCNSJEQAZNAMNTA-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.88
Rot. Bonds3

About N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide

N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide (PubChem CID 108991209) has the molecular formula C22H20N2O and a molecular weight of 328.42 g/mol. Its IUPAC name is N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide
PubChem CID108991209
Molecular FormulaC22H20N2O
Molecular Weight328.42 g/mol
Exact Mass328.16
IUPAC NameN-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide
SMILESO=C(N(Cc1ccccc1)c1ccccc1)N1CCc2ccccc21
InChIInChI=1S/C22H20N2O/c25-22(23-16-15-19-11-7-8-14-21(19)23)24(20-12-5-2-6-13-20)17-18-9-3-1-4-10-18/h1-14H,15-17H2
InChIKeyCNSJEQAZNAMNTA-UHFFFAOYSA-N
XLogP4.88
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-N-prop-2-enyl-2,3-dihydroindole-1-carboxamide
CID 112824415
N-benzyl-N-propan-2-yl-3,4-dihydro-2H-quinoline-1-carboxamide
CID 108990709
N,N-diethyl-2,3-dihydroindole-1-carboxamide
CID 2987329
N-benzyl-2-(2,3-dihydroindol-1-yl)-2-oxoacetamide
CID 108508973
2,3-dihydroindol-1-yl-(2-phenylmethoxyphenyl)methanone
CID 4946349
[5-[benzyl(propan-2-yl)amino]-3-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109239741
1,4-bis(2,3-dihydroindol-1-yl)butane-1,4-dione
CID 741114
2-(2,3-dihydroindol-1-yl)-N-methyl-2-oxo-N-phenylacetamide
CID 108521001
3-(2,3-dihydroindol-1-yl)-N-methyl-3-oxo-N-phenylpropanamide
CID 108953153
2-[butan-2-yl(2,3-dihydroindole-1-carbonyl)amino]acetic acid
CID 61189508
2-[cyclopentyl(2,3-dihydroindole-1-carbonyl)amino]acetic acid
CID 61189507
2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl 2,3-dihydroindole-1-carboxylate
CID 22162806

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide (CID 108991209) is N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide is O=C(N(Cc1ccccc1)c1ccccc1)N1CCc2ccccc21.
What is the InChIKey of N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide?
The InChIKey is CNSJEQAZNAMNTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O/c25-22(23-16-15-19-11-7-8-14-21(19)23)24(20-12-5-2-6-13-20)17-18-9-3-1-4-10-18/h1-14H,15-17H2.
What are the key properties of N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide?
N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 108991209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).