1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide

C13H17NO2 — CID 176955312

IUPAC1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide
SMILESCCC1(C(N)=O)CCc2ccc(OC)cc21
InChIInChI=1S/C13H17NO2/c1-3-13(12(14)15)7-6-9-4-5-10(16-2)8-11(9)13/h4-5,8H,3,6-7H2,1-2H3,(H2,14,15)
InChIKeyZNWSWYQZMCJQFP-UHFFFAOYSA-N
MW219.28 g/mol
LogP1.77
Rot. Bonds3

About 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide

1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide (PubChem CID 176955312) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide.

Molecular Properties

Compound Name1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide
PubChem CID176955312
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide
SMILESCCC1(C(N)=O)CCc2ccc(OC)cc21
InChIInChI=1S/C13H17NO2/c1-3-13(12(14)15)7-6-9-4-5-10(16-2)8-11(9)13/h4-5,8H,3,6-7H2,1-2H3,(H2,14,15)
InChIKeyZNWSWYQZMCJQFP-UHFFFAOYSA-N
XLogP1.77
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-7-methoxy-4-oxo-2,3-dihydronaphthalene-1-carboxamide
CID 172861963
1-ethyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79240760
6-methoxy-1-(2,2,2-trifluoroethylamino)-2,3-dihydroindene-1-carboxamide
CID 79374237
methyl 7-methoxy-1-[2-(methylamino)ethyl]-3,4-dihydro-2H-naphthalene-1-carboxylate
CID 70953559
6-methoxy-1-(4-methylpiperazin-1-yl)-2,3-dihydroindene-1-carboxylic acid
CID 79371968
7-methoxy-1-(2,2,2-trifluoroethylamino)-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 79230787
ethyl 2-(1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalen-1-yl)propanoate
CID 70809295
6-methoxy-1-(propylamino)-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 60796789
6-methoxy-1-(methoxymethyl)-2,3-dihydroinden-1-ol
CID 79568236
[6-methoxy-1-(methylamino)-2,3-dihydroinden-1-yl]methanol
CID 79375001
1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalene-1-carboxylic acid
CID 70241546
2-(butan-2-ylamino)-7-methoxy-3,4-dihydro-1H-naphthalene-2-carboxamide
CID 115510770

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide?
The IUPAC name of 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide (CID 176955312) is 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide.
What is the SMILES notation for 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide?
The canonical SMILES for 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide is CCC1(C(N)=O)CCc2ccc(OC)cc21.
What is the InChIKey of 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide?
The InChIKey is ZNWSWYQZMCJQFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-3-13(12(14)15)7-6-9-4-5-10(16-2)8-11(9)13/h4-5,8H,3,6-7H2,1-2H3,(H2,14,15).
What are the key properties of 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide?
1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide has a molecular weight of 219.28 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methoxy-2,3-dihydroindene-1-carboxamide is sourced from PubChem (CID 176955312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).