[1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate

C23H24N2O3 — CID 123203308

IUPAC[1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate
SMILESCCNC(=O)OCc1c(C)c2n(c1-c1ccc(OC)cc1)-c1ccccc1C2
InChIInChI=1S/C23H24N2O3/c1-4-24-23(26)28-14-19-15(2)21-13-17-7-5-6-8-20(17)25(21)22(19)16-9-11-18(27-3)12-10-16/h5-12H,4,13-14H2,1-3H3,(H,24,26)
InChIKeyCUKTYJPBNISJOX-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.61
Rot. Bonds5

About [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate

[1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate (PubChem CID 123203308) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate.

Molecular Properties

Compound Name[1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate
PubChem CID123203308
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name[1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate
SMILESCCNC(=O)OCc1c(C)c2n(c1-c1ccc(OC)cc1)-c1ccccc1C2
InChIInChI=1S/C23H24N2O3/c1-4-24-23(26)28-14-19-15(2)21-13-17-7-5-6-8-20(17)25(21)22(19)16-9-11-18(27-3)12-10-16/h5-12H,4,13-14H2,1-3H3,(H,24,26)
InChIKeyCUKTYJPBNISJOX-UHFFFAOYSA-N
XLogP4.61
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3,4-dimethoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-methylcarbamate
CID 123526673
(1-methyl-3-phenyl-5,10-dihydropyrrolo[1,2-b]isoquinolin-2-yl)methyl N-methylcarbamate
CID 123623723
methyl 2-[2,3-bis(4-methoxyphenyl)-5-(2-methylpropyl)pyrrol-1-yl]benzoate
CID 129267303
naphthalen-1-ylmethyl N-ethylcarbamate
CID 139990746
2-(4-methoxyphenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]acetamide
CID 110730034
[1-carbamoyloxy-1-(1-ethyl-2-methyl-4H-pyrrolo[1,2-a]indol-3-yl)ethyl] N-methylcarbamate
CID 68916545
2-[4-(1,3-dihydroisoindol-2-yl)-4-oxobutyl]-1-ethyl-3-[2-(4-methoxyphenoxy)ethyl]guanidine
CID 111558829
benzyl N-ethylcarbamate;ethane;molecular hydrogen
CID 143096019
benzyl N-[2-(4-methoxyanilino)-2-oxoethyl]carbamate
CID 60596184
benzyl N-[4-(4-methoxyphenyl)phenyl]carbamate
CID 102104858
(4-methoxyphenyl)methyl N-(2-phenylethyl)carbamate
CID 59492005
N-ethyl-2-[[5-(4-methoxyphenyl)-4-(2-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 2601634

Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate?
The IUPAC name of [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate (CID 123203308) is [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate.
What is the SMILES notation for [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate?
The canonical SMILES for [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate is CCNC(=O)OCc1c(C)c2n(c1-c1ccc(OC)cc1)-c1ccccc1C2.
What is the InChIKey of [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate?
The InChIKey is CUKTYJPBNISJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-4-24-23(26)28-14-19-15(2)21-13-17-7-5-6-8-20(17)25(21)22(19)16-9-11-18(27-3)12-10-16/h5-12H,4,13-14H2,1-3H3,(H,24,26).
What are the key properties of [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate?
[1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate has a molecular weight of 376.46 g/mol, XLogP of 4.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxyphenyl)-3-methyl-4H-pyrrolo[1,2-a]indol-2-yl]methyl N-ethylcarbamate is sourced from PubChem (CID 123203308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).