2,3-dihydro-1H-indene;phenylmethanamine

C16H19N — CID 70078928

IUPAC2,3-dihydro-1H-indene;phenylmethanamine
SMILESNCc1ccccc1.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.C7H9N/c1-2-5-9-7-3-6-8(9)4-1;8-6-7-4-2-1-3-5-7/h1-2,4-5H,3,6-7H2;1-5H,6,8H2
InChIKeyRYFAGUVTUQGHHI-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.32
Rot. Bonds1

About 2,3-dihydro-1H-indene;phenylmethanamine

2,3-dihydro-1H-indene;phenylmethanamine (PubChem CID 70078928) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 2,3-dihydro-1H-indene;phenylmethanamine.

Molecular Properties

Compound Name2,3-dihydro-1H-indene;phenylmethanamine
PubChem CID70078928
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name2,3-dihydro-1H-indene;phenylmethanamine
SMILESNCc1ccccc1.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.C7H9N/c1-2-5-9-7-3-6-8(9)4-1;8-6-7-4-2-1-3-5-7/h1-2,4-5H,3,6-7H2;1-5H,6,8H2
InChIKeyRYFAGUVTUQGHHI-UHFFFAOYSA-N
XLogP3.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indene;phenylmethanamine?
The IUPAC name of 2,3-dihydro-1H-indene;phenylmethanamine (CID 70078928) is 2,3-dihydro-1H-indene;phenylmethanamine.
What is the SMILES notation for 2,3-dihydro-1H-indene;phenylmethanamine?
The canonical SMILES for 2,3-dihydro-1H-indene;phenylmethanamine is NCc1ccccc1.c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-indene;phenylmethanamine?
The InChIKey is RYFAGUVTUQGHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10.C7H9N/c1-2-5-9-7-3-6-8(9)4-1;8-6-7-4-2-1-3-5-7/h1-2,4-5H,3,6-7H2;1-5H,6,8H2.
What are the key properties of 2,3-dihydro-1H-indene;phenylmethanamine?
2,3-dihydro-1H-indene;phenylmethanamine has a molecular weight of 225.33 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indene;phenylmethanamine is sourced from PubChem (CID 70078928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).