5-(1H-pyrrol-2-yl)naphthalen-1-ol

C14H11NO — CID 57034694

IUPAC5-(1H-pyrrol-2-yl)naphthalen-1-ol
SMILESOc1cccc2c(-c3ccc[nH]3)cccc12
InChIInChI=1S/C14H11NO/c16-14-8-2-4-10-11(5-1-6-12(10)14)13-7-3-9-15-13/h1-9,15-16H
InChIKeyUQVQUQGOSHAAME-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.54
Rot. Bonds1

About 5-(1H-pyrrol-2-yl)naphthalen-1-ol

5-(1H-pyrrol-2-yl)naphthalen-1-ol (PubChem CID 57034694) has the molecular formula C14H11NO and a molecular weight of 209.25 g/mol. Its IUPAC name is 5-(1H-pyrrol-2-yl)naphthalen-1-ol.

Molecular Properties

Compound Name5-(1H-pyrrol-2-yl)naphthalen-1-ol
PubChem CID57034694
Molecular FormulaC14H11NO
Molecular Weight209.25 g/mol
Exact Mass209.08
IUPAC Name5-(1H-pyrrol-2-yl)naphthalen-1-ol
SMILESOc1cccc2c(-c3ccc[nH]3)cccc12
InChIInChI=1S/C14H11NO/c16-14-8-2-4-10-11(5-1-6-12(10)14)13-7-3-9-15-13/h1-9,15-16H
InChIKeyUQVQUQGOSHAAME-UHFFFAOYSA-N
XLogP3.54
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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2-(1H-pyrrol-2-yl)phenol;2-thiophen-2-ylphenol
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2-(2-bromophenyl)-1H-pyrrole
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4-(hydroxymethyl)-2-(1H-pyrrol-2-yl)phenol
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2-(4-tert-butyl-1H-pyrrol-2-yl)-6-(1H-pyrrol-2-yl)phenol
CID 142524653
formaldehyde;naphthalene-1,5-diol
CID 21419428
3-bromo-4-(1H-pyrrol-2-yl)phenol
CID 162412006
5-(1H-pyrrol-2-ylmethylamino)naphthalen-1-ol
CID 62327867
4-(1H-pyrrol-2-yl)benzimidazol-2-one
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Frequently Asked Questions

What is the IUPAC name of 5-(1H-pyrrol-2-yl)naphthalen-1-ol?
The IUPAC name of 5-(1H-pyrrol-2-yl)naphthalen-1-ol (CID 57034694) is 5-(1H-pyrrol-2-yl)naphthalen-1-ol.
What is the SMILES notation for 5-(1H-pyrrol-2-yl)naphthalen-1-ol?
The canonical SMILES for 5-(1H-pyrrol-2-yl)naphthalen-1-ol is Oc1cccc2c(-c3ccc[nH]3)cccc12.
What is the InChIKey of 5-(1H-pyrrol-2-yl)naphthalen-1-ol?
The InChIKey is UQVQUQGOSHAAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO/c16-14-8-2-4-10-11(5-1-6-12(10)14)13-7-3-9-15-13/h1-9,15-16H.
What are the key properties of 5-(1H-pyrrol-2-yl)naphthalen-1-ol?
5-(1H-pyrrol-2-yl)naphthalen-1-ol has a molecular weight of 209.25 g/mol, XLogP of 3.54, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-pyrrol-2-yl)naphthalen-1-ol is sourced from PubChem (CID 57034694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).