1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol

C15H21NO2 — CID 114117955

IUPAC1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol
SMILESCOC1CCC(NC2CCc3cc(O)ccc32)C1
InChIInChI=1S/C15H21NO2/c1-18-13-5-3-11(9-13)16-15-7-2-10-8-12(17)4-6-14(10)15/h4,6,8,11,13,15-17H,2-3,5,7,9H2,1H3
InChIKeyIEYRJPIRZYKZBX-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.54
Rot. Bonds3

About 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol

1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol (PubChem CID 114117955) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol
PubChem CID114117955
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol
SMILESCOC1CCC(NC2CCc3cc(O)ccc32)C1
InChIInChI=1S/C15H21NO2/c1-18-13-5-3-11(9-13)16-15-7-2-10-8-12(17)4-6-14(10)15/h4,6,8,11,13,15-17H,2-3,5,7,9H2,1H3
InChIKeyIEYRJPIRZYKZBX-UHFFFAOYSA-N
XLogP2.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-Hydroxy-N-Propargyl-1(R)-Aminoindan
CID 5289289
1-(prop-2-yn-1-ylamino)-2,3-dihydro-1H-inden-4-ol
CID 10236056
(R)-3-Prop-2-ynylamino-indan-5-ol
CID 23644356
(3S)-3-(prop-2-yn-1-ylamino)-2,3-dihydro-1H-inden-5-ol
CID 10125120
(1R)-1-(prop-2-yn-1-ylamino)-2,3-dihydro-1H-inden-4-ol
CID 23645360
2-(butan-2-ylamino)-2,3-dihydro-1H-indene-4,5-diol
CID 44451194
2,3-Dihydro-5-methoxy-N-(1-methylethyl)-1H-inden-1-amine
CID 3016739
2-Benzylamino-indan-5,6-diol
CID 44270599
(3R)-3-(prop-2-enylamino)-2,3-dihydro-1H-inden-5-ol
CID 5326783
(1R)-1-(prop-2-ynylamino)-2,3-dihydro-1H-inden-5-ol
CID 87762274
(1S)-1-[[1-(2-methylpropyl)piperidin-4-yl]amino]-2,3-dihydro-1H-inden-4-ol
CID 97231606
(3R)-3-[methyl(prop-2-enyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 6102778

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol (CID 114117955) is 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol is COC1CCC(NC2CCc3cc(O)ccc32)C1.
What is the InChIKey of 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol?
The InChIKey is IEYRJPIRZYKZBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-18-13-5-3-11(9-13)16-15-7-2-10-8-12(17)4-6-14(10)15/h4,6,8,11,13,15-17H,2-3,5,7,9H2,1H3.
What are the key properties of 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol?
1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol has a molecular weight of 247.34 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 114117955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).