(1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol

C11H15NO — CID 61053796

IUPAC(1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol
SMILESNC1(CO)CCCc2ccccc21
InChIInChI=1S/C11H15NO/c12-11(8-13)7-3-5-9-4-1-2-6-10(9)11/h1-2,4,6,13H,3,5,7-8,12H2
InChIKeyIYEBNYLABGDEEP-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.17
Rot. Bonds1

About (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol

(1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol (PubChem CID 61053796) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol.

Molecular Properties

Compound Name(1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol
PubChem CID61053796
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol
SMILESNC1(CO)CCCc2ccccc21
InChIInChI=1S/C11H15NO/c12-11(8-13)7-3-5-9-4-1-2-6-10(9)11/h1-2,4,6,13H,3,5,7-8,12H2
InChIKeyIYEBNYLABGDEEP-UHFFFAOYSA-N
XLogP1.17
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The IUPAC name of (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol (CID 61053796) is (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol.
What is the SMILES notation for (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The canonical SMILES for (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol is NC1(CO)CCCc2ccccc21.
What is the InChIKey of (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol?
The InChIKey is IYEBNYLABGDEEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c12-11(8-13)7-3-5-9-4-1-2-6-10(9)11/h1-2,4,6,13H,3,5,7-8,12H2.
What are the key properties of (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol?
(1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol has a molecular weight of 177.25 g/mol, XLogP of 1.17, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-3,4-dihydro-2H-naphthalen-1-yl)methanol is sourced from PubChem (CID 61053796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).