(1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine

C23H28N2O2 — CID 30956200

IUPAC(1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine
SMILESCOc1ccccc1[C@H](CNCc1c(OC)ccc2ccccc12)N(C)C
InChIInChI=1S/C23H28N2O2/c1-25(2)21(19-11-7-8-12-22(19)26-3)16-24-15-20-18-10-6-5-9-17(18)13-14-23(20)27-4/h5-14,21,24H,15-16H2,1-4H3/t21-/m0/s1
InChIKeyHMMXZBSAMHNOFX-NRFANRHFSA-N
MW364.49 g/mol
LogP4.25
Rot. Bonds8

About (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine

(1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine (PubChem CID 30956200) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine.

Molecular Properties

Compound Name(1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine
PubChem CID30956200
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC Name(1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine
SMILESCOc1ccccc1[C@H](CNCc1c(OC)ccc2ccccc12)N(C)C
InChIInChI=1S/C23H28N2O2/c1-25(2)21(19-11-7-8-12-22(19)26-3)16-24-15-20-18-10-6-5-9-17(18)13-14-23(20)27-4/h5-14,21,24H,15-16H2,1-4H3/t21-/m0/s1
InChIKeyHMMXZBSAMHNOFX-NRFANRHFSA-N
XLogP4.25
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine with MolForge

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Related Compounds

N-[(2-methoxynaphthalen-1-yl)methyl]-2-methylbutan-1-amine
CID 62693267
1-[2-[(2-methoxynaphthalen-1-yl)methylamino]ethylamino]propan-2-ol;dihydrochloride
CID 17295794
N-[(2-methoxynaphthalen-1-yl)methyl]-2-(2-methylpropoxy)ethanamine
CID 115584591
3-[(2-methoxynaphthalen-1-yl)methylamino]propanenitrile
CID 43215614
1-cyclohexyl-N-[(2-methoxynaphthalen-1-yl)methyl]methanamine
CID 43215559
3,3,3-trifluoro-N-[(2-methoxynaphthalen-1-yl)methyl]propan-1-amine
CID 63226555
1-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylurea
CID 17470191
N-[(2-methoxynaphthalen-1-yl)methyl]butan-2-amine;hydrochloride
CID 17292334
N-[2-(2-methoxynaphthalen-1-yl)ethyl]-2-methylpropan-1-amine
CID 64867903
(2R)-1-[(2-propan-2-yloxynaphthalen-1-yl)methylamino]propan-2-ol
CID 51996892
2-(3,4-dimethoxyphenyl)-N-[(2-methoxynaphthalen-1-yl)methyl]ethanamine
CID 5158918
N-[[2-(2-methoxyethoxy)naphthalen-1-yl]methyl]-2-methylpropan-1-amine
CID 63055930

Frequently Asked Questions

What is the IUPAC name of (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine?
The IUPAC name of (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine (CID 30956200) is (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine.
What is the SMILES notation for (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine?
The canonical SMILES for (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine is COc1ccccc1[C@H](CNCc1c(OC)ccc2ccccc12)N(C)C.
What is the InChIKey of (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine?
The InChIKey is HMMXZBSAMHNOFX-NRFANRHFSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-25(2)21(19-11-7-8-12-22(19)26-3)16-24-15-20-18-10-6-5-9-17(18)13-14-23(20)27-4/h5-14,21,24H,15-16H2,1-4H3/t21-/m0/s1.
What are the key properties of (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine?
(1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine has a molecular weight of 364.49 g/mol, XLogP of 4.25, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N'-[(2-methoxynaphthalen-1-yl)methyl]-1-(2-methoxyphenyl)-N,N-dimethylethane-1,2-diamine is sourced from PubChem (CID 30956200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).