ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine

C16H23NO — CID 142950158

IUPACethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine
SMILESCC.COc1ccc2cc(CN(C)C)ccc2c1
InChIInChI=1S/C14H17NO.C2H6/c1-15(2)10-11-4-5-13-9-14(16-3)7-6-12(13)8-11;1-2/h4-9H,10H2,1-3H3;1-2H3
InChIKeyJAGMRQNEYKXEMU-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.94
Rot. Bonds3

About ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine

ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine (PubChem CID 142950158) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Nameethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine
PubChem CID142950158
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Nameethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine
SMILESCC.COc1ccc2cc(CN(C)C)ccc2c1
InChIInChI=1S/C14H17NO.C2H6/c1-15(2)10-11-4-5-13-9-14(16-3)7-6-12(13)8-11;1-2/h4-9H,10H2,1-3H3;1-2H3
InChIKeyJAGMRQNEYKXEMU-UHFFFAOYSA-N
XLogP3.94
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide
CID 115140024
(6-methoxynaphthalen-2-yl)methanethiol
CID 79884829
CID 15863483
CID 15863483
1-hydroxy-1-[(6-methoxynaphthalen-2-yl)methyl]urea
CID 19780510
(2R)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N,N-dimethylpropanamide
CID 8925163
2-[(6-methoxynaphthalen-2-yl)methyl-propylamino]acetic acid
CID 65064840
(2R)-2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpropanamide
CID 119272237
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]butanoic acid
CID 65068401
2-N-[(6-methoxynaphthalen-2-yl)methyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 82944857
1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine
CID 22070460
1-[1,3-benzodioxol-5-ylmethyl-[(6-methoxynaphthalen-2-yl)methyl]amino]propan-2-ol
CID 46962137
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 9053961

Frequently Asked Questions

What is the IUPAC name of ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine (CID 142950158) is ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine is CC.COc1ccc2cc(CN(C)C)ccc2c1.
What is the InChIKey of ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine?
The InChIKey is JAGMRQNEYKXEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO.C2H6/c1-15(2)10-11-4-5-13-9-14(16-3)7-6-12(13)8-11;1-2/h4-9H,10H2,1-3H3;1-2H3.
What are the key properties of ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine?
ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine has a molecular weight of 245.37 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 142950158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).