N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide

C15H20N2O2 — CID 110855362

IUPACN-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1cccc2c(CC(=O)NC(C)(C)C)c[nH]c12
InChIInChI=1S/C15H20N2O2/c1-15(2,3)17-13(18)8-10-9-16-14-11(10)6-5-7-12(14)19-4/h5-7,9,16H,8H2,1-4H3,(H,17,18)
InChIKeyRLTWSMKNFHCWTC-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.63
Rot. Bonds3

About N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide

N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide (PubChem CID 110855362) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide
PubChem CID110855362
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1cccc2c(CC(=O)NC(C)(C)C)c[nH]c12
InChIInChI=1S/C15H20N2O2/c1-15(2,3)17-13(18)8-10-9-16-14-11(10)6-5-7-12(14)19-4/h5-7,9,16H,8H2,1-4H3,(H,17,18)
InChIKeyRLTWSMKNFHCWTC-UHFFFAOYSA-N
XLogP2.63
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
CID 110847883
N-cyclopentyl-2-(7-methoxy-1H-indol-3-yl)acetamide
CID 110848702
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
(2S)-1-(7-methoxy-1H-indol-3-yl)-4-methyl-2-(propan-2-ylamino)pentan-3-one
CID 177080560
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
16-(7-methoxy-1H-indol-3-yl)hexadecan-1-ol
CID 11429148
3-(benzenesulfonylmethyl)-7-methoxy-1H-indole
CID 146164758
5-(7-methoxy-1H-indol-3-yl)pentan-1-amine
CID 96598611
N-tert-butyl-2-(2-methoxyphenoxy)acetamide
CID 922262
ethyl 2-(7-methoxy-1H-indol-3-yl)butanoate
CID 102584302

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide (CID 110855362) is N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide is COc1cccc2c(CC(=O)NC(C)(C)C)c[nH]c12.
What is the InChIKey of N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide?
The InChIKey is RLTWSMKNFHCWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-15(2,3)17-13(18)8-10-9-16-14-11(10)6-5-7-12(14)19-4/h5-7,9,16H,8H2,1-4H3,(H,17,18).
What are the key properties of N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide?
N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide has a molecular weight of 260.34 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(7-methoxy-1H-indol-3-yl)acetamide is sourced from PubChem (CID 110855362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).