N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine

C17H20N2O — CID 62322027

IUPACN-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cccc(Oc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C17H20N2O/c1-2-18-12-15-7-4-8-17(19-15)20-16-10-9-13-5-3-6-14(13)11-16/h4,7-11,18H,2-3,5-6,12H2,1H3
InChIKeyIMRHSYUFPMFIMX-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.47
Rot. Bonds5

About N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine

N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine (PubChem CID 62322027) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine
PubChem CID62322027
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cccc(Oc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C17H20N2O/c1-2-18-12-15-7-4-8-17(19-15)20-16-10-9-13-5-3-6-14(13)11-16/h4,7-11,18H,2-3,5-6,12H2,1H3
InChIKeyIMRHSYUFPMFIMX-UHFFFAOYSA-N
XLogP3.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(chloromethyl)-6-(2,3-dihydro-1H-inden-5-yloxy)pyridine
CID 62240738
N-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyridin-2-amine
CID 80872364
N-[[6-(3-chlorophenoxy)-2-pyridinyl]methyl]ethanamine
CID 62323929
N-[[4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-2-pyridinyl]methyl]ethanamine
CID 62321397
N-[[6-(3-chloro-4-fluorophenoxy)-2-pyridinyl]methyl]ethanamine
CID 55257457
N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methyl]ethanamine
CID 63552028
1-[6-(2,3-dihydro-1H-inden-5-yloxymethyl)-2-pyridinyl]-N-methylmethanamine
CID 106908170
N-[[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]methyl]ethanamine
CID 62323863
N-[[4-(2,3-dihydro-1H-inden-5-yloxy)-3-pyridinyl]methyl]ethanamine
CID 81250662
N-[[4-(2,3-dihydro-1H-inden-5-yloxy)-6-methyl-3-pyridinyl]methyl]ethanamine
CID 81255357
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine
CID 130164614
N-[[3-chloro-4-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]ethanamine
CID 81152008

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine (CID 62322027) is N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine is CCNCc1cccc(Oc2ccc3c(c2)CCC3)n1.
What is the InChIKey of N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine?
The InChIKey is IMRHSYUFPMFIMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-18-12-15-7-4-8-17(19-15)20-16-10-9-13-5-3-6-14(13)11-16/h4,7-11,18H,2-3,5-6,12H2,1H3.
What are the key properties of N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine?
N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine has a molecular weight of 268.36 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62322027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).