N-(1H-indol-2-ylmethyl)acetamide

C11H12N2O — CID 66552376

IUPACN-(1H-indol-2-ylmethyl)acetamide
SMILESCC(=O)NCc1cc2ccccc2[nH]1
InChIInChI=1S/C11H12N2O/c1-8(14)12-7-10-6-9-4-2-3-5-11(9)13-10/h2-6,13H,7H2,1H3,(H,12,14)
InChIKeyCWNRIQZYVBZHMT-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.80
Rot. Bonds2

About N-(1H-indol-2-ylmethyl)acetamide

N-(1H-indol-2-ylmethyl)acetamide (PubChem CID 66552376) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is N-(1H-indol-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(1H-indol-2-ylmethyl)acetamide
PubChem CID66552376
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC NameN-(1H-indol-2-ylmethyl)acetamide
SMILESCC(=O)NCc1cc2ccccc2[nH]1
InChIInChI=1S/C11H12N2O/c1-8(14)12-7-10-6-9-4-2-3-5-11(9)13-10/h2-6,13H,7H2,1H3,(H,12,14)
InChIKeyCWNRIQZYVBZHMT-UHFFFAOYSA-N
XLogP1.80
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze N-(1H-indol-2-ylmethyl)acetamide 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

1H-indol-2-ylmethylcarbamic acid
CID 68691362
N-[2-(1H-indol-2-yl)ethyl]acetamide
CID 10465460
2-hydroxy-N-(1H-indol-2-ylmethyl)-4-methylpentanamide
CID 86286685
(2S)-2-amino-N-(1H-indol-2-ylmethyl)-3,3-dimethylbutanamide
CID 90653128
1-(1H-indol-2-ylmethyl)-2,3-dimethylguanidine
CID 47091801
4-(1H-indol-2-yl)butan-2-one
CID 10954278
1-(4-hydroxy-2,2-dimethylbutyl)-3-(1H-indol-2-ylmethyl)urea
CID 111505462
(3S)-3-amino-4-(1H-indol-2-ylmethylamino)-4-oxobutanoic acid
CID 69296115
2-acetamido-3-(1H-indol-3-yl)-N-(1H-indol-2-ylmethyl)propanamide
CID 47086404
N-(1H-indol-2-ylmethyl)formamide
CID 54534530
4-chloro-N-(1H-indol-2-ylmethyl)-1-methylpyrazole-5-carboxamide
CID 843728
1-[(2-bromo-5-fluorophenyl)methyl]-3-(1H-indol-2-ylmethyl)urea
CID 86870795

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-2-ylmethyl)acetamide?
The IUPAC name of N-(1H-indol-2-ylmethyl)acetamide (CID 66552376) is N-(1H-indol-2-ylmethyl)acetamide.
What is the SMILES notation for N-(1H-indol-2-ylmethyl)acetamide?
The canonical SMILES for N-(1H-indol-2-ylmethyl)acetamide is CC(=O)NCc1cc2ccccc2[nH]1.
What is the InChIKey of N-(1H-indol-2-ylmethyl)acetamide?
The InChIKey is CWNRIQZYVBZHMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-8(14)12-7-10-6-9-4-2-3-5-11(9)13-10/h2-6,13H,7H2,1H3,(H,12,14).
What are the key properties of N-(1H-indol-2-ylmethyl)acetamide?
N-(1H-indol-2-ylmethyl)acetamide has a molecular weight of 188.23 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-2-ylmethyl)acetamide is sourced from PubChem (CID 66552376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).