(1-methylindol-5-yl) N,N-dimethylcarbamate

C12H14N2O2 — CID 135084485

IUPAC(1-methylindol-5-yl) N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1ccc2c(ccn2C)c1
InChIInChI=1S/C12H14N2O2/c1-13(2)12(15)16-10-4-5-11-9(8-10)6-7-14(11)3/h4-8H,1-3H3
InChIKeyDHLHSFOVNYBHAA-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.24
Rot. Bonds1

About (1-methylindol-5-yl) N,N-dimethylcarbamate

(1-methylindol-5-yl) N,N-dimethylcarbamate (PubChem CID 135084485) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is (1-methylindol-5-yl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(1-methylindol-5-yl) N,N-dimethylcarbamate
PubChem CID135084485
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name(1-methylindol-5-yl) N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1ccc2c(ccn2C)c1
InChIInChI=1S/C12H14N2O2/c1-13(2)12(15)16-10-4-5-11-9(8-10)6-7-14(11)3/h4-8H,1-3H3
InChIKeyDHLHSFOVNYBHAA-UHFFFAOYSA-N
XLogP2.24
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (1-methylindol-5-yl) N,N-dimethylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methoxy-1-methylindole
CID 819864
2-methyl-2-(1-methylindol-5-yl)propanoic acid
CID 115114970
(6-bromonaphthalen-2-yl) N,N-dimethylcarbamate
CID 807327
CID 67486113
CID 67486113
2-[5-(dimethylcarbamothioyloxy)indol-1-yl]acetic acid
CID 22504941
methyl (E)-3-(1-methylindol-5-yl)prop-2-enoate
CID 67563454
[3-(dimethylamino)-4-methylphenyl] N,N-dimethylcarbamate
CID 23621926
3-(1-methylindol-5-yl)oxypropan-1-amine
CID 84672497
[6-(1-methylpiperidin-2-yl)naphthalen-2-yl] N,N-dimethylcarbamate
CID 3029533
(4-aminophenyl) N,N-dimethylcarbamate
CID 21427559
bis(1-methylindol-5-yl)borinic acid
CID 140671665
N-methyl-N-(1-methylindol-5-yl)benzamide
CID 54508219

Frequently Asked Questions

What is the IUPAC name of (1-methylindol-5-yl) N,N-dimethylcarbamate?
The IUPAC name of (1-methylindol-5-yl) N,N-dimethylcarbamate (CID 135084485) is (1-methylindol-5-yl) N,N-dimethylcarbamate.
What is the SMILES notation for (1-methylindol-5-yl) N,N-dimethylcarbamate?
The canonical SMILES for (1-methylindol-5-yl) N,N-dimethylcarbamate is CN(C)C(=O)Oc1ccc2c(ccn2C)c1.
What is the InChIKey of (1-methylindol-5-yl) N,N-dimethylcarbamate?
The InChIKey is DHLHSFOVNYBHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-13(2)12(15)16-10-4-5-11-9(8-10)6-7-14(11)3/h4-8H,1-3H3.
What are the key properties of (1-methylindol-5-yl) N,N-dimethylcarbamate?
(1-methylindol-5-yl) N,N-dimethylcarbamate has a molecular weight of 218.26 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylindol-5-yl) N,N-dimethylcarbamate is sourced from PubChem (CID 135084485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).