5-(dimethylamino)naphthalen-1-ol

C12H13NO — CID 18539756

IUPAC5-(dimethylamino)naphthalen-1-ol
SMILESCN(C)c1cccc2c(O)cccc12
InChIInChI=1S/C12H13NO/c1-13(2)11-7-3-6-10-9(11)5-4-8-12(10)14/h3-8,14H,1-2H3
InChIKeyVCQYBGKTUNHQPD-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.61
Rot. Bonds1

About 5-(dimethylamino)naphthalen-1-ol

5-(dimethylamino)naphthalen-1-ol (PubChem CID 18539756) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 5-(dimethylamino)naphthalen-1-ol.

Molecular Properties

Compound Name5-(dimethylamino)naphthalen-1-ol
PubChem CID18539756
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name5-(dimethylamino)naphthalen-1-ol
SMILESCN(C)c1cccc2c(O)cccc12
InChIInChI=1S/C12H13NO/c1-13(2)11-7-3-6-10-9(11)5-4-8-12(10)14/h3-8,14H,1-2H3
InChIKeyVCQYBGKTUNHQPD-UHFFFAOYSA-N
XLogP2.61
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)naphthalen-1-ol?
The IUPAC name of 5-(dimethylamino)naphthalen-1-ol (CID 18539756) is 5-(dimethylamino)naphthalen-1-ol.
What is the SMILES notation for 5-(dimethylamino)naphthalen-1-ol?
The canonical SMILES for 5-(dimethylamino)naphthalen-1-ol is CN(C)c1cccc2c(O)cccc12.
What is the InChIKey of 5-(dimethylamino)naphthalen-1-ol?
The InChIKey is VCQYBGKTUNHQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-13(2)11-7-3-6-10-9(11)5-4-8-12(10)14/h3-8,14H,1-2H3.
What are the key properties of 5-(dimethylamino)naphthalen-1-ol?
5-(dimethylamino)naphthalen-1-ol has a molecular weight of 187.24 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)naphthalen-1-ol is sourced from PubChem (CID 18539756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).