3-amino-2-anilinonaphthalen-1-ol

C16H14N2O — CID 154387368

IUPAC3-amino-2-anilinonaphthalen-1-ol
SMILESNc1cc2ccccc2c(O)c1Nc1ccccc1
InChIInChI=1S/C16H14N2O/c17-14-10-11-6-4-5-9-13(11)16(19)15(14)18-12-7-2-1-3-8-12/h1-10,18-19H,17H2
InChIKeyKVEHOPHTLVYIMT-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.87
Rot. Bonds2

About 3-amino-2-anilinonaphthalen-1-ol

3-amino-2-anilinonaphthalen-1-ol (PubChem CID 154387368) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-amino-2-anilinonaphthalen-1-ol.

Molecular Properties

Compound Name3-amino-2-anilinonaphthalen-1-ol
PubChem CID154387368
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name3-amino-2-anilinonaphthalen-1-ol
SMILESNc1cc2ccccc2c(O)c1Nc1ccccc1
InChIInChI=1S/C16H14N2O/c17-14-10-11-6-4-5-9-13(11)16(19)15(14)18-12-7-2-1-3-8-12/h1-10,18-19H,17H2
InChIKeyKVEHOPHTLVYIMT-UHFFFAOYSA-N
XLogP3.87
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

2-aminonaphthalene-1,3-diol
CID 118669960
2-anilino-3-chloronaphthalene-1-carboxylic acid
CID 57143139
phenanthren-9-amine
CID 13695
1-anilinonaphthalene-2-sulfonic acid
CID 14694055
N-phenylphenanthren-2-amine
CID 23175030
2-amino-6-anilinophenol
CID 23106882
2-aminonaphthalen-1-ol;ethane
CID 143085377
phenol;N-phenylnaphthalen-1-amine
CID 159146578
2,6-difluoro-1-N-phenylbenzene-1,4-diamine
CID 61017044
2,3-dianilinonaphthalene-1-sulfonate
CID 22506510
1-(1-anilinonaphthalen-2-yl)ethanone
CID 12580778
1-anthracen-9-yl-3-phenylurea
CID 102213486

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-anilinonaphthalen-1-ol?
The IUPAC name of 3-amino-2-anilinonaphthalen-1-ol (CID 154387368) is 3-amino-2-anilinonaphthalen-1-ol.
What is the SMILES notation for 3-amino-2-anilinonaphthalen-1-ol?
The canonical SMILES for 3-amino-2-anilinonaphthalen-1-ol is Nc1cc2ccccc2c(O)c1Nc1ccccc1.
What is the InChIKey of 3-amino-2-anilinonaphthalen-1-ol?
The InChIKey is KVEHOPHTLVYIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c17-14-10-11-6-4-5-9-13(11)16(19)15(14)18-12-7-2-1-3-8-12/h1-10,18-19H,17H2.
What are the key properties of 3-amino-2-anilinonaphthalen-1-ol?
3-amino-2-anilinonaphthalen-1-ol has a molecular weight of 250.30 g/mol, XLogP of 3.87, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-anilinonaphthalen-1-ol is sourced from PubChem (CID 154387368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).