1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine

C14H16N2O2 — CID 113378023

IUPAC1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine
SMILESCNCc1coc(Oc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C14H16N2O2/c1-15-8-12-9-17-14(16-12)18-13-6-5-10-3-2-4-11(10)7-13/h5-7,9,15H,2-4,8H2,1H3
InChIKeyOHYUTTJTCUUZOK-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.67
Rot. Bonds4

About 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine

1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine (PubChem CID 113378023) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine
PubChem CID113378023
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine
SMILESCNCc1coc(Oc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C14H16N2O2/c1-15-8-12-9-17-14(16-12)18-13-6-5-10-3-2-4-11(10)7-13/h5-7,9,15H,2-4,8H2,1H3
InChIKeyOHYUTTJTCUUZOK-UHFFFAOYSA-N
XLogP2.67
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(1,3-benzodioxol-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine
CID 113377970
N,N-dimethyl-3-[[4-(methylaminomethyl)-1,3-oxazol-2-yl]oxy]aniline
CID 113378039
1-[6-(2,3-dihydro-1H-inden-5-yloxymethyl)-2-pyridinyl]-N-methylmethanamine
CID 106908170
1-[3-(2,3-dihydro-1H-inden-5-yloxy)phenyl]-N-methylmethanamine
CID 63942120
N-[[6-(2,3-dihydro-1H-inden-5-yloxy)-2-pyridinyl]methyl]ethanamine
CID 62322027
1-[3-(2,3-dihydro-1H-inden-5-yloxy)-5-fluorophenyl]-N-methylmethanamine
CID 106531226
N-methyl-1-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]methanamine
CID 63551846
1-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-yl]-N-methylmethanamine
CID 62459453
2-(2,3-dihydro-1H-inden-5-yloxy)-N-methylethanamine
CID 14809522
2-(chloromethyl)-6-(2,3-dihydro-1H-inden-5-yloxy)pyridine
CID 62240738
1-[3-chloro-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)phenyl]-N-methylmethanamine
CID 81152018
1-[1,3-dimethyl-5-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrazol-4-yl]-N-methylmethanamine
CID 61398675

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine (CID 113378023) is 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine is CNCc1coc(Oc2ccc3c(c2)CCC3)n1.
What is the InChIKey of 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine?
The InChIKey is OHYUTTJTCUUZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-15-8-12-9-17-14(16-12)18-13-6-5-10-3-2-4-11(10)7-13/h5-7,9,15H,2-4,8H2,1H3.
What are the key properties of 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine?
1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine has a molecular weight of 244.29 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine is sourced from PubChem (CID 113378023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).