2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine

C17H23NO — CID 79616716

IUPAC2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine
SMILESCCCNC(c1ccc2ccccc2c1)C(C)OC
InChIInChI=1S/C17H23NO/c1-4-11-18-17(13(2)19-3)16-10-9-14-7-5-6-8-15(14)12-16/h5-10,12-13,17-18H,4,11H2,1-3H3
InChIKeyYXQHQOBBBOFPDN-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.92
Rot. Bonds6

About 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine

2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine (PubChem CID 79616716) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine.

Molecular Properties

Compound Name2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine
PubChem CID79616716
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine
SMILESCCCNC(c1ccc2ccccc2c1)C(C)OC
InChIInChI=1S/C17H23NO/c1-4-11-18-17(13(2)19-3)16-10-9-14-7-5-6-8-15(14)12-16/h5-10,12-13,17-18H,4,11H2,1-3H3
InChIKeyYXQHQOBBBOFPDN-UHFFFAOYSA-N
XLogP3.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-naphthalen-2-yl-N-propylbutan-2-amine
CID 66437220
2-methoxy-1-(4-propoxyphenyl)-N-propylpropan-1-amine
CID 79617326
1-(3-fluoro-4-methoxyphenyl)-2-methoxy-N-propylpropan-1-amine
CID 79617446
2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 79196999
1-(3,5-difluorophenyl)-2-methoxy-N-propylpropan-1-amine
CID 79616365
2,2-dimethyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 63413588
2-naphthalen-2-yl-2-(propylamino)ethanol
CID 61055183
N-ethyl-2,3-dimethyl-1-naphthalen-2-ylbutan-1-amine
CID 115851123
2-methoxy-1-(5-methylthiophen-3-yl)-N-propylpropan-1-amine
CID 79616237
N-[naphthalen-2-yl(pyrimidin-2-yl)methyl]propan-1-amine
CID 62790717
2-naphthalen-2-yl-2-(propylamino)acetic acid
CID 43754123
2,2-dimethyl-1-naphthalen-2-yl-N-propylbutan-1-amine
CID 115851112

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine?
The IUPAC name of 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine (CID 79616716) is 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine.
What is the SMILES notation for 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine?
The canonical SMILES for 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine is CCCNC(c1ccc2ccccc2c1)C(C)OC.
What is the InChIKey of 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine?
The InChIKey is YXQHQOBBBOFPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-4-11-18-17(13(2)19-3)16-10-9-14-7-5-6-8-15(14)12-16/h5-10,12-13,17-18H,4,11H2,1-3H3.
What are the key properties of 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine?
2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine has a molecular weight of 257.38 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine is sourced from PubChem (CID 79616716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).