1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine

C16H19NO — CID 115506198

IUPAC1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine
SMILESCOc1ccc2cccc(CC(N)C3CC3)c2c1
InChIInChI=1S/C16H19NO/c1-18-14-8-7-11-3-2-4-13(15(11)10-14)9-16(17)12-5-6-12/h2-4,7-8,10,12,16H,5-6,9,17H2,1H3
InChIKeyOVUOXUUVKGATHJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.13
Rot. Bonds4

About 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine

1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine (PubChem CID 115506198) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine
PubChem CID115506198
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine
SMILESCOc1ccc2cccc(CC(N)C3CC3)c2c1
InChIInChI=1S/C16H19NO/c1-18-14-8-7-11-3-2-4-13(15(11)10-14)9-16(17)12-5-6-12/h2-4,7-8,10,12,16H,5-6,9,17H2,1H3
InChIKeyOVUOXUUVKGATHJ-UHFFFAOYSA-N
XLogP3.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(7-methoxynaphthalen-1-yl)-3-propan-2-yloxypropan-2-amine
CID 115506207
1-(7-methoxynaphthalen-1-yl)-3-methylbut-3-en-2-amine
CID 115506222
3-cyclopropyl-2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]propanoic acid
CID 120535790
1-(7-methoxynaphthalen-1-yl)-4-methylsulfonylbutan-2-amine
CID 115506223
4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine
CID 115506243
1-(3-methylcyclopentyl)-2-naphthalen-1-ylethanamine
CID 65413962
[1-(7-methoxynaphthalen-1-yl)-3,3-dimethylbutan-2-yl]hydrazine
CID 105260340
1-cyclopropyl-3-(7-methoxynaphthalen-1-yl)propan-2-one
CID 113325067
1-(furan-3-yl)-2-(7-methoxynaphthalen-1-yl)ethanamine
CID 115506225
1-(7-methoxynaphthalen-1-yl)-3-thiophen-2-ylpropan-2-amine
CID 115506200
1-(7-methoxynaphthalen-1-yl)hept-6-en-2-amine
CID 115506237
1-(7-methoxynaphthalen-1-yl)-3-phenylpropan-2-ol
CID 115506158

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
The IUPAC name of 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine (CID 115506198) is 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
The canonical SMILES for 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine is COc1ccc2cccc(CC(N)C3CC3)c2c1.
What is the InChIKey of 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
The InChIKey is OVUOXUUVKGATHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-18-14-8-7-11-3-2-4-13(15(11)10-14)9-16(17)12-5-6-12/h2-4,7-8,10,12,16H,5-6,9,17H2,1H3.
What are the key properties of 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine is sourced from PubChem (CID 115506198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).