N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine

C14H19NO — CID 63359821

IUPACN-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine
SMILESc1ccc2c(c1)CCC2NC1CCCOC1
InChIInChI=1S/C14H19NO/c1-2-6-13-11(4-1)7-8-14(13)15-12-5-3-9-16-10-12/h1-2,4,6,12,14-15H,3,5,7-10H2
InChIKeyRWOYNPVEXPZELO-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.44
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine

N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine (PubChem CID 63359821) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine
PubChem CID63359821
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine
SMILESc1ccc2c(c1)CCC2NC1CCCOC1
InChIInChI=1S/C14H19NO/c1-2-6-13-11(4-1)7-8-14(13)15-12-5-3-9-16-10-12/h1-2,4,6,12,14-15H,3,5,7-10H2
InChIKeyRWOYNPVEXPZELO-UHFFFAOYSA-N
XLogP2.44
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine (CID 63359821) is N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine is c1ccc2c(c1)CCC2NC1CCCOC1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine?
The InChIKey is RWOYNPVEXPZELO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-6-13-11(4-1)7-8-14(13)15-12-5-3-9-16-10-12/h1-2,4,6,12,14-15H,3,5,7-10H2.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine?
N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine has a molecular weight of 217.31 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)oxan-3-amine is sourced from PubChem (CID 63359821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).