2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide

C14H18N2O2 — CID 110847883

IUPAC2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
SMILESCOc1cccc2c(CC(=O)NC(C)C)c[nH]c12
InChIInChI=1S/C14H18N2O2/c1-9(2)16-13(17)7-10-8-15-14-11(10)5-4-6-12(14)18-3/h4-6,8-9,15H,7H2,1-3H3,(H,16,17)
InChIKeyDQGODHVVZYJXRW-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.24
Rot. Bonds4

About 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide

2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide (PubChem CID 110847883) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
PubChem CID110847883
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
SMILESCOc1cccc2c(CC(=O)NC(C)C)c[nH]c12
InChIInChI=1S/C14H18N2O2/c1-9(2)16-13(17)7-10-8-15-14-11(10)5-4-6-12(14)18-3/h4-6,8-9,15H,7H2,1-3H3,(H,16,17)
InChIKeyDQGODHVVZYJXRW-UHFFFAOYSA-N
XLogP2.24
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide
CID 110855362
N-cyclopentyl-2-(7-methoxy-1H-indol-3-yl)acetamide
CID 110848702
(2S)-1-(7-methoxy-1H-indol-3-yl)-4-methyl-2-(propan-2-ylamino)pentan-3-one
CID 177080560
1-(azepan-1-yl)-2-(7-methoxy-1H-indol-3-yl)ethanone
CID 110856311
2-amino-3-(7-methoxy-1H-indol-3-yl)propanoic acid;ethane
CID 145142398
1-(7-methoxy-1H-indol-3-yl)-2-(propan-2-ylamino)ethanone
CID 96675265
2-(5-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
CID 110847876
2-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]propanoic acid
CID 119225264
2-[(2,3-dimethoxyphenyl)methylamino]-N-propan-2-ylacetamide
CID 43400002
3-methyl-2-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pentanoic acid
CID 119211734
1-(4-ethylpiperazin-1-yl)-2-(7-methoxy-1H-indol-3-yl)ethanone
CID 110849938
2-(7-methoxy-1H-indol-3-yl)acetonitrile
CID 604224

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide (CID 110847883) is 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide is COc1cccc2c(CC(=O)NC(C)C)c[nH]c12.
What is the InChIKey of 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide?
The InChIKey is DQGODHVVZYJXRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-9(2)16-13(17)7-10-8-15-14-11(10)5-4-6-12(14)18-3/h4-6,8-9,15H,7H2,1-3H3,(H,16,17).
What are the key properties of 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide?
2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide has a molecular weight of 246.31 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 110847883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).