N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine

C19H23NO — CID 63552028

IUPACN-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine
SMILESCCNCc1ccccc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C19H23NO/c1-2-20-14-17-9-5-6-10-19(17)21-18-12-11-15-7-3-4-8-16(15)13-18/h5-6,9-13,20H,2-4,7-8,14H2,1H3
InChIKeyRPTLVVZMDGRLIA-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.47
Rot. Bonds5

About N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine

N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine (PubChem CID 63552028) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine
PubChem CID63552028
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine
SMILESCCNCc1ccccc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C19H23NO/c1-2-20-14-17-9-5-6-10-19(17)21-18-12-11-15-7-3-4-8-16(15)13-18/h5-6,9-13,20H,2-4,7-8,14H2,1H3
InChIKeyRPTLVVZMDGRLIA-UHFFFAOYSA-N
XLogP4.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine
CID 63551846
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]propan-2-amine
CID 43283537
N-[[4-(2,3-dihydro-1H-inden-5-yloxy)-3-pyridinyl]methyl]ethanamine
CID 81250662
N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]methyl]ethanamine
CID 62323863
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]cyclopropanamine
CID 43283536
N-[[4-(2,3-dihydro-1H-inden-5-yloxy)-6-methyl-3-pyridinyl]methyl]ethanamine
CID 81255357
N-[[3-chloro-4-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]ethanamine
CID 81152008
N-[[2-(3,4-dichlorophenoxy)phenyl]methyl]ethanamine;hydrochloride
CID 126796280
N-[[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-2-pyridinyl]methyl]ethanamine
CID 62321397
N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine
CID 62322027
N-[[3-(2,3-dihydro-1H-inden-5-yloxy)-4-pyridinyl]methyl]propan-1-amine
CID 105075463
2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)benzaldehyde
CID 55224942

Frequently Asked Questions

What is the IUPAC name of N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine?
The IUPAC name of N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine (CID 63552028) is N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine is CCNCc1ccccc1Oc1ccc2c(c1)CCCC2.
What is the InChIKey of N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine?
The InChIKey is RPTLVVZMDGRLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-20-14-17-9-5-6-10-19(17)21-18-12-11-15-7-3-4-8-16(15)13-18/h5-6,9-13,20H,2-4,7-8,14H2,1H3.
What are the key properties of N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine?
N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine has a molecular weight of 281.40 g/mol, XLogP of 4.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine is sourced from PubChem (CID 63552028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).