N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide

C16H23N3O2 — CID 102916591

IUPACN-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide
SMILESCNCc1ccc2ccn(CC(=O)NC(C)COC)c2c1
InChIInChI=1S/C16H23N3O2/c1-12(11-21-3)18-16(20)10-19-7-6-14-5-4-13(9-17-2)8-15(14)19/h4-8,12,17H,9-11H2,1-3H3,(H,18,20)
InChIKeyYPXJCKVMAHUUPL-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.51
Rot. Bonds7

About N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide

N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide (PubChem CID 102916591) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide
PubChem CID102916591
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide
SMILESCNCc1ccc2ccn(CC(=O)NC(C)COC)c2c1
InChIInChI=1S/C16H23N3O2/c1-12(11-21-3)18-16(20)10-19-7-6-14-5-4-13(9-17-2)8-15(14)19/h4-8,12,17H,9-11H2,1-3H3,(H,18,20)
InChIKeyYPXJCKVMAHUUPL-UHFFFAOYSA-N
XLogP1.51
TPSA55.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yl-2-[6-[(propan-2-ylamino)methyl]indol-1-yl]acetamide
CID 102916880
N-(3-methoxypropyl)-2-[5-(methylaminomethyl)indol-1-yl]acetamide
CID 102915716
2-[6-(methylaminomethyl)indol-1-yl]-1-piperidin-1-ylethanone
CID 102916558
2-[6-(hydroxymethyl)indol-1-yl]-N-(2-methoxyethyl)acetamide
CID 102913025
2-(6-aminoindol-1-yl)-N-butan-2-ylacetamide
CID 43308924
2-(6-bromo-4-oxoquinolin-1-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 100737711
2-[6-(methylaminomethyl)indol-1-yl]ethanol
CID 102916522
2-(6-aminoindol-1-yl)-N-pentan-2-ylacetamide
CID 61490204
2-[6-(hydroxymethyl)indol-1-yl]-N-(3-methoxypropyl)acetamide
CID 102912972
N-(1-methoxypropan-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 51174931
2-(6-bromoindol-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 116621827
1-[1-(2-ethylbutyl)indol-6-yl]-N-methylmethanamine
CID 82924593

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide (CID 102916591) is N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide is CNCc1ccc2ccn(CC(=O)NC(C)COC)c2c1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide?
The InChIKey is YPXJCKVMAHUUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-12(11-21-3)18-16(20)10-19-7-6-14-5-4-13(9-17-2)8-15(14)19/h4-8,12,17H,9-11H2,1-3H3,(H,18,20).
What are the key properties of N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide?
N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide has a molecular weight of 289.38 g/mol, XLogP of 1.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-[6-(methylaminomethyl)indol-1-yl]acetamide is sourced from PubChem (CID 102916591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).