N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide

C15H21NO2 — CID 11053973

IUPACN-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
SMILESCCC(=O)NCCC1CCc2ccc(OC)cc21
InChIInChI=1S/C15H21NO2/c1-3-15(17)16-9-8-12-5-4-11-6-7-13(18-2)10-14(11)12/h6-7,10,12H,3-5,8-9H2,1-2H3,(H,16,17)
InChIKeyBURWKXUNJOXCGV-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.64
Rot. Bonds5

About N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide

N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide (PubChem CID 11053973) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
PubChem CID11053973
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
SMILESCCC(=O)NCCC1CCc2ccc(OC)cc21
InChIInChI=1S/C15H21NO2/c1-3-15(17)16-9-8-12-5-4-11-6-7-13(18-2)10-14(11)12/h6-7,10,12H,3-5,8-9H2,1-2H3,(H,16,17)
InChIKeyBURWKXUNJOXCGV-UHFFFAOYSA-N
XLogP2.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Agomelatine
CID 82148
Ramelteon
CID 208902
Tasimelteon
CID 10220503
N-(2-(1,6,7,8-Tetrahydro-2H-indeno(5,4-b)furan-8-yl)ethyl)propanamide
CID 9881626
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
N-[3-(3-methoxyphenyl)propyl]acetamide
CID 10750842
N-[(6-Methoxy-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)methyl]acetamide
CID 11185529
Cifea
CID 53238181
N-cyclopropylcarbonyl-2-(7-methoxy-1-naphthyl)ethylamine
CID 164405
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-2-methyl-
CID 3071630
Pentanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071632

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
The IUPAC name of N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide (CID 11053973) is N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide is CCC(=O)NCCC1CCc2ccc(OC)cc21.
What is the InChIKey of N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
The InChIKey is BURWKXUNJOXCGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-3-15(17)16-9-8-12-5-4-11-6-7-13(18-2)10-14(11)12/h6-7,10,12H,3-5,8-9H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide has a molecular weight of 247.34 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide is sourced from PubChem (CID 11053973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).