2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide

C13H17N3O — CID 82495529

IUPAC2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
SMILESCn1cc(CCNC(=O)CN)c2ccccc21
InChIInChI=1S/C13H17N3O/c1-16-9-10(6-7-15-13(17)8-14)11-4-2-3-5-12(11)16/h2-5,9H,6-8,14H2,1H3,(H,15,17)
InChIKeyVJJFUYXEXNUPSW-UHFFFAOYSA-N
MW231.30 g/mol
LogP0.80
Rot. Bonds4

About 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide

2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide (PubChem CID 82495529) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
PubChem CID82495529
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
SMILESCn1cc(CCNC(=O)CN)c2ccccc21
InChIInChI=1S/C13H17N3O/c1-16-9-10(6-7-15-13(17)8-14)11-4-2-3-5-12(11)16/h2-5,9H,6-8,14H2,1H3,(H,15,17)
InChIKeyVJJFUYXEXNUPSW-UHFFFAOYSA-N
XLogP0.80
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 11196581
methyl N-[2-(1-methylindol-3-yl)ethyl]carbamate
CID 14613226
N-(2-aminoethyl)-2-(1-methylindol-3-yl)acetamide
CID 82289252
N-[2-(1-methylindol-3-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110731525
2-amino-N-(2-naphthalen-1-ylethyl)acetamide
CID 115151700
N-ethyl-3-(1-methylindol-3-yl)propanamide
CID 167074114
N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide
CID 45069388
3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 71702593
N-(2-methoxyethyl)-2-(1-methylindol-3-yl)acetamide
CID 3237946
1-cyclopentyl-3-[2-(1-methylindol-3-yl)ethyl]urea
CID 110748890
4-(1-methylindol-3-yl)butanamide
CID 175206986

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide (CID 82495529) is 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide is Cn1cc(CCNC(=O)CN)c2ccccc21.
What is the InChIKey of 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
The InChIKey is VJJFUYXEXNUPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-16-9-10(6-7-15-13(17)8-14)11-4-2-3-5-12(11)16/h2-5,9H,6-8,14H2,1H3,(H,15,17).
What are the key properties of 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide has a molecular weight of 231.30 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide is sourced from PubChem (CID 82495529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).