2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride

C13H18ClN3O — CID 155858615

IUPAC2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride
SMILESCc1ccc2c(c1)c(CCN)cn2CC(N)=O.Cl
InChIInChI=1S/C13H17N3O.ClH/c1-9-2-3-12-11(6-9)10(4-5-14)7-16(12)8-13(15)17;/h2-3,6-7H,4-5,8,14H2,1H3,(H2,15,17);1H
InChIKeyWHWHXVIECPXCOQ-UHFFFAOYSA-N
MW267.76 g/mol
LogP1.36
Rot. Bonds4

About 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride

2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride (PubChem CID 155858615) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride
PubChem CID155858615
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride
SMILESCc1ccc2c(c1)c(CCN)cn2CC(N)=O.Cl
InChIInChI=1S/C13H17N3O.ClH/c1-9-2-3-12-11(6-9)10(4-5-14)7-16(12)8-13(15)17;/h2-3,6-7H,4-5,8,14H2,1H3,(H2,15,17);1H
InChIKeyWHWHXVIECPXCOQ-UHFFFAOYSA-N
XLogP1.36
TPSA74.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride 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

2-(1,5-dimethylindol-3-yl)ethanamine;hydrochloride
CID 18933143
3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine
CID 176928919
2-[3-(2-aminoethyl)-5-propan-2-ylindol-1-yl]acetic acid
CID 83945028
3-[3-(2-aminoethyl)indol-1-yl]propanamide
CID 55164863
N-[2-(5-methyl-1-propylindol-3-yl)ethyl]propanamide
CID 122425297
3-(2-aminoethyl)-1-(3-aminopropyl)indole-5-carboxylic acid
CID 83963355
[3-(2-aminoethyl)-1-ethylindol-5-yl]methanesulfonamide
CID 70378764
3-[3-(2-aminoethyl)-5-ethylindol-1-yl]propan-1-amine
CID 83948758
2-[5-methyl-3-(3-piperazin-1-ylpropyl)indol-1-yl]ethanamine
CID 83948925
methyl 2-[5-methyl-3-(3-piperazin-1-ylpropyl)indol-1-yl]acetate
CID 83949055
2-(3-benzyl-6-methyl-4-oxoquinolin-1-yl)acetic acid
CID 141141284
2-(3-acetyl-5-methylindol-1-yl)-N-methylacetamide
CID 117098611

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride?
The IUPAC name of 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride (CID 155858615) is 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride.
What is the SMILES notation for 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride?
The canonical SMILES for 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride is Cc1ccc2c(c1)c(CCN)cn2CC(N)=O.Cl.
What is the InChIKey of 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride?
The InChIKey is WHWHXVIECPXCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O.ClH/c1-9-2-3-12-11(6-9)10(4-5-14)7-16(12)8-13(15)17;/h2-3,6-7H,4-5,8,14H2,1H3,(H2,15,17);1H.
What are the key properties of 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride?
2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride has a molecular weight of 267.76 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride is sourced from PubChem (CID 155858615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).