N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine

C21H23NO — CID 3299087

IUPACN-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine
SMILESCOc1ccc2ccccc2c1CN(C)CCc1ccccc1
InChIInChI=1S/C21H23NO/c1-22(15-14-17-8-4-3-5-9-17)16-20-19-11-7-6-10-18(19)12-13-21(20)23-2/h3-13H,14-16H2,1-2H3
InChIKeyUOJNFTKCWQDYLV-UHFFFAOYSA-N
MW305.42 g/mol
LogP4.52
Rot. Bonds6

About N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine

N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine (PubChem CID 3299087) has the molecular formula C21H23NO and a molecular weight of 305.42 g/mol. Its IUPAC name is N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine.

Molecular Properties

Compound NameN-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine
PubChem CID3299087
Molecular FormulaC21H23NO
Molecular Weight305.42 g/mol
Exact Mass305.18
IUPAC NameN-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine
SMILESCOc1ccc2ccccc2c1CN(C)CCc1ccccc1
InChIInChI=1S/C21H23NO/c1-22(15-14-17-8-4-3-5-9-17)16-20-19-11-7-6-10-18(19)12-13-21(20)23-2/h3-13H,14-16H2,1-2H3
InChIKeyUOJNFTKCWQDYLV-UHFFFAOYSA-N
XLogP4.52
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine 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'-[(2-methoxynaphthalen-1-yl)methyl]-N'-methylethane-1,2-diamine
CID 62682753
3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine
CID 170865305
N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-2-phenylethanamine
CID 782861
N,N-bis[(2-methoxynaphthalen-1-yl)methyl]butan-1-amine
CID 53235294
benzyl-[(2-methoxynaphthalen-1-yl)methyl]-methylazanium
CID 7322225
N-methyl-3-phenyl-N-[(2,4,6-trimethoxyphenyl)methyl]propan-1-amine
CID 146255660
1-(2-methoxynaphthalen-1-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine
CID 75451786
N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-1-[(3S)-oxolan-3-yl]methanamine
CID 97160391
2-[3-(2-methoxynaphthalen-1-yl)phenyl]-N-methyl-N-(2-phenylethyl)acetamide
CID 10669237
3-[cyclopentyl-[(2-methoxynaphthalen-1-yl)methyl]amino]propanoic acid
CID 119135272
2-methoxy-1,6-bis[(2-methoxynaphthalen-1-yl)methyl]naphthalene
CID 139095345
N-[(2,6-dichlorophenyl)methyl]-2-(3,4-dimethoxyphenyl)-N-methylethanamine
CID 1376281

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine?
The IUPAC name of N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine (CID 3299087) is N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine.
What is the SMILES notation for N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine?
The canonical SMILES for N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine is COc1ccc2ccccc2c1CN(C)CCc1ccccc1.
What is the InChIKey of N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine?
The InChIKey is UOJNFTKCWQDYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO/c1-22(15-14-17-8-4-3-5-9-17)16-20-19-11-7-6-10-18(19)12-13-21(20)23-2/h3-13H,14-16H2,1-2H3.
What are the key properties of N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine?
N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine has a molecular weight of 305.42 g/mol, XLogP of 4.52, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine is sourced from PubChem (CID 3299087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).