2,3-dihydro-1H-indene;propan-1-amine

C12H19N — CID 18516594

IUPAC2,3-dihydro-1H-indene;propan-1-amine
SMILESCCCN.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.C3H9N/c1-2-5-9-7-3-6-8(9)4-1;1-2-3-4/h1-2,4-5H,3,6-7H2;2-4H2,1H3
InChIKeyTVKDTBPAGHRUBR-UHFFFAOYSA-N
MW177.29 g/mol
LogP2.53
Rot. Bonds1

About 2,3-dihydro-1H-indene;propan-1-amine

2,3-dihydro-1H-indene;propan-1-amine (PubChem CID 18516594) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 2,3-dihydro-1H-indene;propan-1-amine.

Molecular Properties

Compound Name2,3-dihydro-1H-indene;propan-1-amine
PubChem CID18516594
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name2,3-dihydro-1H-indene;propan-1-amine
SMILESCCCN.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.C3H9N/c1-2-5-9-7-3-6-8(9)4-1;1-2-3-4/h1-2,4-5H,3,6-7H2;2-4H2,1H3
InChIKeyTVKDTBPAGHRUBR-UHFFFAOYSA-N
XLogP2.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 52.53
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;propan-1-amine?
The IUPAC name of 2,3-dihydro-1H-indene;propan-1-amine (CID 18516594) is 2,3-dihydro-1H-indene;propan-1-amine.
What is the SMILES notation for 2,3-dihydro-1H-indene;propan-1-amine?
The canonical SMILES for 2,3-dihydro-1H-indene;propan-1-amine is CCCN.c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-indene;propan-1-amine?
The InChIKey is TVKDTBPAGHRUBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10.C3H9N/c1-2-5-9-7-3-6-8(9)4-1;1-2-3-4/h1-2,4-5H,3,6-7H2;2-4H2,1H3.
What are the key properties of 2,3-dihydro-1H-indene;propan-1-amine?
2,3-dihydro-1H-indene;propan-1-amine has a molecular weight of 177.29 g/mol, XLogP of 2.53, 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;propan-1-amine is sourced from PubChem (CID 18516594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).