(1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate

C24H24N2O2 — CID 86659883

IUPAC(1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate
SMILESCC(C)c1ccc(NC(=O)Oc2ccc3c(c2)CCN3c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c1-17(2)18-8-10-20(11-9-18)25-24(27)28-22-12-13-23-19(16-22)14-15-26(23)21-6-4-3-5-7-21/h3-13,16-17H,14-15H2,1-2H3,(H,25,27)
InChIKeyUGRPQFAQOMVGGW-UHFFFAOYSA-N
MW372.47 g/mol
LogP6.12
Rot. Bonds4

About (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate

(1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate (PubChem CID 86659883) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate.

Molecular Properties

Compound Name(1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate
PubChem CID86659883
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name(1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate
SMILESCC(C)c1ccc(NC(=O)Oc2ccc3c(c2)CCN3c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c1-17(2)18-8-10-20(11-9-18)25-24(27)28-22-12-13-23-19(16-22)14-15-26(23)21-6-4-3-5-7-21/h3-13,16-17H,14-15H2,1-2H3,(H,25,27)
InChIKeyUGRPQFAQOMVGGW-UHFFFAOYSA-N
XLogP6.12
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 56.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-benzyl-2,3-dihydroindol-5-yl) N-(4-phenylphenyl)carbamate
CID 86659871
[(3aR,8bS)-3-(2,2-diphenylethyl)-4,8b-dimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-(4-propan-2-ylphenyl)carbamate
CID 46880287
phenyl N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]carbamate
CID 7656784
1-methylsulfonyl-N-(4-propan-2-ylphenyl)-2,3-dihydroindole-5-carboxamide
CID 24761444
[(8bS)-3-benzyl-8b-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-7-yl] N-(4-propan-2-ylphenyl)carbamate
CID 11953524
8b-methyl-7-[(4-propan-2-ylphenyl)carbamoyloxy]-1,2,3,3a-tetrahydropyrrolo[2,3-b]indole-4-carboxylic acid
CID 123918770
(4,8b-dimethyl-1,2,3,3a-tetrahydropyrrolo[2,3-b]indol-7-yl) N-(4-propan-2-ylphenyl)carbamate
CID 609285
[(8bR)-4,8b-dimethyl-2,3a-dihydro-1H-furo[2,3-b]indol-7-yl] N-(4-propan-2-ylphenyl)carbamate
CID 23645295
phenyl N-[4-(4-methylpiperazin-1-yl)phenyl]carbamate
CID 4552577
phenyl N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]carbamate
CID 16927201
[4-[4-[4-(phenoxycarbonylamino)phenyl]piperazin-1-yl]phenyl] acetate
CID 68857508
N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-ethylbutanamide
CID 112986176

Frequently Asked Questions

What is the IUPAC name of (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate?
The IUPAC name of (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate (CID 86659883) is (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate.
What is the SMILES notation for (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate?
The canonical SMILES for (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate is CC(C)c1ccc(NC(=O)Oc2ccc3c(c2)CCN3c2ccccc2)cc1.
What is the InChIKey of (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate?
The InChIKey is UGRPQFAQOMVGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-17(2)18-8-10-20(11-9-18)25-24(27)28-22-12-13-23-19(16-22)14-15-26(23)21-6-4-3-5-7-21/h3-13,16-17H,14-15H2,1-2H3,(H,25,27).
What are the key properties of (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate?
(1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate has a molecular weight of 372.47 g/mol, XLogP of 6.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-phenyl-2,3-dihydroindol-5-yl) N-(4-propan-2-ylphenyl)carbamate is sourced from PubChem (CID 86659883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).