N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride

C16H22ClNO — CID 22666549

IUPACN,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride
SMILESCN(C)CCOCCc1cccc2ccccc12.Cl
InChIInChI=1S/C16H21NO.ClH/c1-17(2)11-13-18-12-10-15-8-5-7-14-6-3-4-9-16(14)15;/h3-9H,10-13H2,1-2H3;1H
InChIKeyUNRVLHQKEGKBAZ-UHFFFAOYSA-N
MW279.81 g/mol
LogP3.38
Rot. Bonds6

About N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride

N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride (PubChem CID 22666549) has the molecular formula C16H22ClNO and a molecular weight of 279.81 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride
PubChem CID22666549
Molecular FormulaC16H22ClNO
Molecular Weight279.81 g/mol
Exact Mass279.14
IUPAC NameN,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride
SMILESCN(C)CCOCCc1cccc2ccccc12.Cl
InChIInChI=1S/C16H21NO.ClH/c1-17(2)11-13-18-12-10-15-8-5-7-14-6-3-4-9-16(14)15;/h3-9H,10-13H2,1-2H3;1H
InChIKeyUNRVLHQKEGKBAZ-UHFFFAOYSA-N
XLogP3.38
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.81
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dimethyl-16-naphthalen-1-ylhexadecan-1-amine;hydrochloride
CID 174059419
1-[3-(3-naphthalen-1-ylpropoxy)propyl]naphthalene
CID 139748426
CID 140892810
CID 140892810
N-methyl-N-(2-naphthalen-1-ylethyl)propan-2-amine
CID 117044251
1-(2-phenylmethoxyethyl)naphthalene
CID 71507589
3-[2-(2-naphthalen-1-ylethoxy)ethoxy]propanenitrile
CID 69073430
CID 140892702
CID 140892702
2-naphthalen-1-yl-N,N-bis(2-naphthalen-1-ylethyl)ethanamine
CID 129196216
2-(dimethylamino)ethyl-dimethyl-(naphthalen-1-ylmethyl)azanium
CID 101160835
2-naphthalen-1-ylethyl acetate
CID 592920
N-[2-(diethylamino)ethyl]-N-(2-hydroxyethyl)-3-(2-naphthalen-1-ylethoxy)propanamide
CID 66933701
1-(4-methoxybutyl)naphthalene
CID 69278949

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride?
The IUPAC name of N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride (CID 22666549) is N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride.
What is the SMILES notation for N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride?
The canonical SMILES for N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride is CN(C)CCOCCc1cccc2ccccc12.Cl.
What is the InChIKey of N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride?
The InChIKey is UNRVLHQKEGKBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO.ClH/c1-17(2)11-13-18-12-10-15-8-5-7-14-6-3-4-9-16(14)15;/h3-9H,10-13H2,1-2H3;1H.
What are the key properties of N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride?
N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride has a molecular weight of 279.81 g/mol, XLogP of 3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-naphthalen-1-ylethoxy)ethanamine;hydrochloride is sourced from PubChem (CID 22666549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).