2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide

C15H22N2O2 — CID 107683580

IUPAC2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide
SMILESCCNC1CCc2cc(OC(CC)C(N)=O)ccc21
InChIInChI=1S/C15H22N2O2/c1-3-14(15(16)18)19-11-6-7-12-10(9-11)5-8-13(12)17-4-2/h6-7,9,13-14,17H,3-5,8H2,1-2H3,(H2,16,18)
InChIKeyBFDOYHSZHRKFQX-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.93
Rot. Bonds6

About 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide

2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide (PubChem CID 107683580) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide.

Molecular Properties

Compound Name2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide
PubChem CID107683580
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide
SMILESCCNC1CCc2cc(OC(CC)C(N)=O)ccc21
InChIInChI=1S/C15H22N2O2/c1-3-14(15(16)18)19-11-6-7-12-10(9-11)5-8-13(12)17-4-2/h6-7,9,13-14,17H,3-5,8H2,1-2H3,(H2,16,18)
InChIKeyBFDOYHSZHRKFQX-UHFFFAOYSA-N
XLogP1.93
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]propanoate
CID 107683817
5-butan-2-yloxy-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 107683888
ethyl 2-[[5-(methylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]butanoate
CID 64670120
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]-N-(2-methylpropyl)acetamide
CID 107683613
5-pentan-3-yloxy-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 107683877
1-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]-3-methoxypropan-2-ol
CID 107683826
N-cyclopropyl-3-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]propanamide
CID 107683586
N-ethyl-5-(2-ethylcyclohexyl)oxy-2,3-dihydro-1H-inden-1-amine
CID 107683841
5-but-2-ynoxy-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 107683611
3-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxymethyl]phenol
CID 107683685
5-[2-(diethylamino)ethoxy]-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 107683747
2-[3-[(cyclopropylamino)methyl]phenoxy]butanamide
CID 55131413

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide?
The IUPAC name of 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide (CID 107683580) is 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide.
What is the SMILES notation for 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide?
The canonical SMILES for 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide is CCNC1CCc2cc(OC(CC)C(N)=O)ccc21.
What is the InChIKey of 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide?
The InChIKey is BFDOYHSZHRKFQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-14(15(16)18)19-11-6-7-12-10(9-11)5-8-13(12)17-4-2/h6-7,9,13-14,17H,3-5,8H2,1-2H3,(H2,16,18).
What are the key properties of 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide?
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide has a molecular weight of 262.35 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(ethylamino)-2,3-dihydro-1H-inden-5-yl]oxy]butanamide is sourced from PubChem (CID 107683580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).