1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol

C18H21NO2 — CID 107682035

IUPAC1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol
SMILESCCCOc1cccc(NC2CCc3cc(O)ccc32)c1
InChIInChI=1S/C18H21NO2/c1-2-10-21-16-5-3-4-14(12-16)19-18-9-6-13-11-15(20)7-8-17(13)18/h3-5,7-8,11-12,18-20H,2,6,9-10H2,1H3
InChIKeyYTZUNXFWJSINPM-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.28
Rot. Bonds5

About 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol

1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol (PubChem CID 107682035) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol
PubChem CID107682035
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol
SMILESCCCOc1cccc(NC2CCc3cc(O)ccc32)c1
InChIInChI=1S/C18H21NO2/c1-2-10-21-16-5-3-4-14(12-16)19-18-9-6-13-11-15(20)7-8-17(13)18/h3-5,7-8,11-12,18-20H,2,6,9-10H2,1H3
InChIKeyYTZUNXFWJSINPM-UHFFFAOYSA-N
XLogP4.28
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(3-ethoxyphenyl)-2,3-dihydro-1H-indene-1,5-diamine
CID 79730721
methyl 3-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]benzoate
CID 107681939
1-(4-ethylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107681814
N-(3-propoxyphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 43693706
N-(3-propoxyphenyl)-3,4-dihydro-1H-isothiochromen-4-amine
CID 43783332
1-(4-ethoxy-2-methylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682196
5-fluoro-N-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 115916737
1-(4-bromoanilino)-2,3-dihydro-1H-inden-5-ol
CID 107681800
1-(4-fluoro-3-methoxyanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682716
2-[3-(2,3-dihydro-1H-inden-1-ylamino)phenoxy]acetonitrile
CID 43721237
1-[[6-(dimethylamino)-3-pyridinyl]amino]-2,3-dihydro-1H-inden-5-ol
CID 107682026
1-[4-(difluoromethoxy)anilino]-2,3-dihydro-1H-inden-5-ol
CID 107681840

Frequently Asked Questions

What is the IUPAC name of 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol (CID 107682035) is 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol is CCCOc1cccc(NC2CCc3cc(O)ccc32)c1.
What is the InChIKey of 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol?
The InChIKey is YTZUNXFWJSINPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-2-10-21-16-5-3-4-14(12-16)19-18-9-6-13-11-15(20)7-8-17(13)18/h3-5,7-8,11-12,18-20H,2,6,9-10H2,1H3.
What are the key properties of 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol?
1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol has a molecular weight of 283.37 g/mol, XLogP of 4.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-propoxyanilino)-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107682035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).