(2-naphthalen-1-ylethylamino)methanol

C13H15NO — CID 115229403

IUPAC(2-naphthalen-1-ylethylamino)methanol
SMILESOCNCCc1cccc2ccccc12
InChIInChI=1S/C13H15NO/c15-10-14-9-8-12-6-3-5-11-4-1-2-7-13(11)12/h1-7,14-15H,8-10H2
InChIKeyPMVZOELJHGPHSF-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.92
Rot. Bonds4

About (2-naphthalen-1-ylethylamino)methanol

(2-naphthalen-1-ylethylamino)methanol (PubChem CID 115229403) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is (2-naphthalen-1-ylethylamino)methanol.

Molecular Properties

Compound Name(2-naphthalen-1-ylethylamino)methanol
PubChem CID115229403
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name(2-naphthalen-1-ylethylamino)methanol
SMILESOCNCCc1cccc2ccccc12
InChIInChI=1S/C13H15NO/c15-10-14-9-8-12-6-3-5-11-4-1-2-7-13(11)12/h1-7,14-15H,8-10H2
InChIKeyPMVZOELJHGPHSF-UHFFFAOYSA-N
XLogP1.92
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-methyl-1-(2-naphthalen-1-ylethylamino)propan-2-ol
CID 115137096
N-(2-naphthalen-1-ylethyl)prop-2-yn-1-amine
CID 87606018
3-[(2-naphthalen-1-ylethylamino)methyl]cyclobutan-1-amine
CID 115214333
3-(2-naphthalen-1-ylethylamino)propane-1-sulfonic acid
CID 87095275
3-naphthalen-1-ylpropan-1-ol
CID 14711518
ethane;2-naphthalen-1-ylethanol
CID 145119048
acetaldehyde;N-methyl-2-naphthalen-1-ylethanamine
CID 142942330
3-hydroxy-N-(2-naphthalen-1-ylethyl)propanamide
CID 115139376
2-(3-naphthalen-1-ylpropylamino)acetamide;dihydrochloride
CID 69310962
3-methyl-2-(2-naphthalen-1-ylethylamino)butan-1-ol
CID 115137751
1-N-(2-naphthalen-1-ylethyl)pentane-1,4-diamine
CID 115204071
N-[(3-iodophenyl)methyl]-2-naphthalen-1-ylethanamine
CID 68867683

Frequently Asked Questions

What is the IUPAC name of (2-naphthalen-1-ylethylamino)methanol?
The IUPAC name of (2-naphthalen-1-ylethylamino)methanol (CID 115229403) is (2-naphthalen-1-ylethylamino)methanol.
What is the SMILES notation for (2-naphthalen-1-ylethylamino)methanol?
The canonical SMILES for (2-naphthalen-1-ylethylamino)methanol is OCNCCc1cccc2ccccc12.
What is the InChIKey of (2-naphthalen-1-ylethylamino)methanol?
The InChIKey is PMVZOELJHGPHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c15-10-14-9-8-12-6-3-5-11-4-1-2-7-13(11)12/h1-7,14-15H,8-10H2.
What are the key properties of (2-naphthalen-1-ylethylamino)methanol?
(2-naphthalen-1-ylethylamino)methanol has a molecular weight of 201.27 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-naphthalen-1-ylethylamino)methanol is sourced from PubChem (CID 115229403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).