6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol

C14H19NO — CID 117309765

IUPAC6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol
SMILESNC1(c2cc3c(cc2O)CCC3)CCCC1
InChIInChI=1S/C14H19NO/c15-14(6-1-2-7-14)12-8-10-4-3-5-11(10)9-13(12)16/h8-9,16H,1-7,15H2
InChIKeyHPKVGCDEINWIBK-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.61
Rot. Bonds1

About 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol

6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol (PubChem CID 117309765) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol
PubChem CID117309765
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol
SMILESNC1(c2cc3c(cc2O)CCC3)CCCC1
InChIInChI=1S/C14H19NO/c15-14(6-1-2-7-14)12-8-10-4-3-5-11(10)9-13(12)16/h8-9,16H,1-7,15H2
InChIKeyHPKVGCDEINWIBK-UHFFFAOYSA-N
XLogP2.61
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

2-(1-aminocyclopropyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ol
CID 84785545
1-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)cyclohexan-1-amine
CID 117371666
2,3-dihydro-1H-indene-5,6-diol
CID 13058959
2-(1-aminocyclopentyl)-4-fluoro-5-methylphenol
CID 117298959
2-(1-aminocyclohexyl)-4-bromophenol
CID 82625595
2-(1-aminocyclopentyl)-4-methoxy-5-methylphenol
CID 117316532
1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)cyclohexan-1-amine
CID 117360955
2-(1-aminocyclohexyl)-5-chloro-4-methoxyphenol
CID 117392379
4-(1-aminocyclohexyl)-2-bromo-5-fluorophenol
CID 84814370
2-(1-aminocyclohexyl)-4-methylsulfanylphenol
CID 117347880
6-[2-(1-aminocyclopropyl)ethyl]-2,3-dihydro-1H-inden-5-ol
CID 105471605
2-(1-aminocyclobutyl)-5-chlorophenol
CID 82607167

Frequently Asked Questions

What is the IUPAC name of 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol (CID 117309765) is 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol is NC1(c2cc3c(cc2O)CCC3)CCCC1.
What is the InChIKey of 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol?
The InChIKey is HPKVGCDEINWIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c15-14(6-1-2-7-14)12-8-10-4-3-5-11(10)9-13(12)16/h8-9,16H,1-7,15H2.
What are the key properties of 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol?
6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol has a molecular weight of 217.31 g/mol, XLogP of 2.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-aminocyclopentyl)-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 117309765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).