1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine

C22H25NO — CID 2845235

IUPAC1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine
SMILESCOc1ccc(CC(C)N(C)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C22H25NO/c1-17(15-18-11-13-21(24-3)14-12-18)23(2)16-20-9-6-8-19-7-4-5-10-22(19)20/h4-14,17H,15-16H2,1-3H3
InChIKeyRZUKLYYDURBWJF-UHFFFAOYSA-N
MW319.45 g/mol
LogP4.91
Rot. Bonds6

About 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine

1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine (PubChem CID 2845235) has the molecular formula C22H25NO and a molecular weight of 319.45 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine
PubChem CID2845235
Molecular FormulaC22H25NO
Molecular Weight319.45 g/mol
Exact Mass319.19
IUPAC Name1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine
SMILESCOc1ccc(CC(C)N(C)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C22H25NO/c1-17(15-18-11-13-21(24-3)14-12-18)23(2)16-20-9-6-8-19-7-4-5-10-22(19)20/h4-14,17H,15-16H2,1-3H3
InChIKeyRZUKLYYDURBWJF-UHFFFAOYSA-N
XLogP4.91
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine 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

2-N-[(4-methoxyphenyl)methyl]-2-N-methylpropane-1,2-diamine
CID 61420599
N-benzyl-N-methyl-1-phenylpropan-2-amine
CID 2341
(2R)-2-[methyl(naphthalen-1-ylmethyl)amino]propanoic acid
CID 94522375
3-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)prop-2-en-1-amine
CID 54202558
(2R)-N-[(4-methoxyphenyl)methyl]-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanamide
CID 26002941
1-(4-butan-2-ylphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)methanamine
CID 19893363
3-(diaminomethylidene)-2-[(4-methoxyphenyl)methyl]-1-methyl-1-(naphthalen-1-ylmethyl)guanidine;hydrochloride
CID 53308168
N-methyl-N-(2-naphthalen-1-ylethyl)propan-2-amine
CID 117044251
(1S,2S)-N-methyl-N-(naphthalen-1-ylmethyl)-1-phenyl-1-phenylmethoxypropan-2-amine
CID 10408396
N-[(4-iodophenyl)methyl]-1-(2-methoxyphenyl)-N-methylpropan-2-amine
CID 65486312
2-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)ethanamine
CID 2063744
(2R)-2-[(2-chlorophenyl)methyl-methylamino]-N-[(4-methoxyphenyl)methyl]propanamide
CID 8541611

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine?
The IUPAC name of 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine (CID 2845235) is 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine is COc1ccc(CC(C)N(C)Cc2cccc3ccccc23)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine?
The InChIKey is RZUKLYYDURBWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO/c1-17(15-18-11-13-21(24-3)14-12-18)23(2)16-20-9-6-8-19-7-4-5-10-22(19)20/h4-14,17H,15-16H2,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine?
1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine has a molecular weight of 319.45 g/mol, XLogP of 4.91, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)propan-2-amine is sourced from PubChem (CID 2845235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).