N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine

C19H25NO — CID 62116847

IUPACN-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine
SMILESCCCNC(COC1CCC1)c1cccc2ccccc12
InChIInChI=1S/C19H25NO/c1-2-13-20-19(14-21-16-9-6-10-16)18-12-5-8-15-7-3-4-11-17(15)18/h3-5,7-8,11-12,16,19-20H,2,6,9-10,13-14H2,1H3
InChIKeyWFNOHDIBNMABIS-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.45
Rot. Bonds7

About N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine

N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine (PubChem CID 62116847) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine
PubChem CID62116847
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC NameN-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine
SMILESCCCNC(COC1CCC1)c1cccc2ccccc12
InChIInChI=1S/C19H25NO/c1-2-13-20-19(14-21-16-9-6-10-16)18-12-5-8-15-7-3-4-11-17(15)18/h3-5,7-8,11-12,16,19-20H,2,6,9-10,13-14H2,1H3
InChIKeyWFNOHDIBNMABIS-UHFFFAOYSA-N
XLogP4.45
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-cyclobutyloxy-1-(2-methoxyphenyl)ethyl]propan-1-amine
CID 55040870
3-methyl-1-naphthalen-1-yl-N-propylbutan-1-amine
CID 55188123
2-cyclobutyloxy-1-(2-ethoxyphenyl)-N-ethylethanamine
CID 62114747
N-[2-cyclohexyloxy-1-(2,4-dimethylphenyl)ethyl]propan-1-amine
CID 63475749
3,3-dimethyl-1-naphthalen-1-yl-N-propylbutan-1-amine
CID 63890250
N-[2-cyclopentyloxy-1-(4-propylphenyl)ethyl]propan-1-amine
CID 63473597
N-(2-cyclopropyl-2-methoxy-1-naphthalen-1-ylethyl)propan-1-amine
CID 116722797
N-[naphthalen-1-yl(thiolan-2-yl)methyl]propan-1-amine
CID 80627227
2-cyclohexyl-N-ethyl-1-naphthalen-1-ylethanamine
CID 63416140
N-[2-(3,5-dimethylcyclohexyl)oxy-1-phenylethyl]propan-1-amine
CID 64728979
1-cyclobutyloxy-3,3-dimethyl-N-propylbutan-2-amine
CID 62116848
N-ethyl-3-methyl-1-naphthalen-1-ylbutan-1-amine
CID 62715882

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine?
The IUPAC name of N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine (CID 62116847) is N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine.
What is the SMILES notation for N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine?
The canonical SMILES for N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine is CCCNC(COC1CCC1)c1cccc2ccccc12.
What is the InChIKey of N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine?
The InChIKey is WFNOHDIBNMABIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-2-13-20-19(14-21-16-9-6-10-16)18-12-5-8-15-7-3-4-11-17(15)18/h3-5,7-8,11-12,16,19-20H,2,6,9-10,13-14H2,1H3.
What are the key properties of N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine?
N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine has a molecular weight of 283.41 g/mol, XLogP of 4.45, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutyloxy-1-naphthalen-1-ylethyl)propan-1-amine is sourced from PubChem (CID 62116847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).