N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine

C15H13F2N — CID 43512842

IUPACN-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESFc1ccc(NC2Cc3ccccc3C2)c(F)c1
InChIInChI=1S/C15H13F2N/c16-12-5-6-15(14(17)9-12)18-13-7-10-3-1-2-4-11(10)8-13/h1-6,9,13,18H,7-8H2
InChIKeyBKOPWVHKQNATPW-UHFFFAOYSA-N
MW245.27 g/mol
LogP3.54
Rot. Bonds2

About N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine

N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 43512842) has the molecular formula C15H13F2N and a molecular weight of 245.27 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID43512842
Molecular FormulaC15H13F2N
Molecular Weight245.27 g/mol
Exact Mass245.10
IUPAC NameN-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESFc1ccc(NC2Cc3ccccc3C2)c(F)c1
InChIInChI=1S/C15H13F2N/c16-12-5-6-15(14(17)9-12)18-13-7-10-3-1-2-4-11(10)8-13/h1-6,9,13,18H,7-8H2
InChIKeyBKOPWVHKQNATPW-UHFFFAOYSA-N
XLogP3.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.27
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine (CID 43512842) is N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine is Fc1ccc(NC2Cc3ccccc3C2)c(F)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is BKOPWVHKQNATPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2N/c16-12-5-6-15(14(17)9-12)18-13-7-10-3-1-2-4-11(10)8-13/h1-6,9,13,18H,7-8H2.
What are the key properties of N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine?
N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 245.27 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 43512842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).