5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine

C15H15FN2 — CID 116532007

IUPAC5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine
SMILESNC1(Cc2ccccn2)CCc2cc(F)ccc21
InChIInChI=1S/C15H15FN2/c16-12-4-5-14-11(9-12)6-7-15(14,17)10-13-3-1-2-8-18-13/h1-5,8-9H,6-7,10,17H2
InChIKeyAXZSRRCQHXEJCF-UHFFFAOYSA-N
MW242.30 g/mol
LogP2.56
Rot. Bonds2

About 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine

5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine (PubChem CID 116532007) has the molecular formula C15H15FN2 and a molecular weight of 242.30 g/mol. Its IUPAC name is 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine.

Molecular Properties

Compound Name5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine
PubChem CID116532007
Molecular FormulaC15H15FN2
Molecular Weight242.30 g/mol
Exact Mass242.12
IUPAC Name5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine
SMILESNC1(Cc2ccccn2)CCc2cc(F)ccc21
InChIInChI=1S/C15H15FN2/c16-12-4-5-14-11(9-12)6-7-15(14,17)10-13-3-1-2-8-18-13/h1-5,8-9H,6-7,10,17H2
InChIKeyAXZSRRCQHXEJCF-UHFFFAOYSA-N
XLogP2.56
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-ol
CID 116531617
1-[(3-chlorophenyl)methyl]-5-fluoro-2,3-dihydroinden-1-amine
CID 116532021
1-[(1-butan-2-ylpyrazol-3-yl)methyl]-5-fluoro-2,3-dihydroinden-1-amine
CID 116532032
1-(pyridin-2-ylmethyl)cyclopropan-1-amine
CID 59327087
1-(cyclohexylmethyl)-5-fluoro-2,3-dihydroinden-1-amine
CID 116531949
4-methyl-1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 115419894
5-fluoro-1-quinolin-7-yl-2,3-dihydroinden-1-amine
CID 116532073
5-fluoro-2-(pyridin-2-ylmethyl)phenol
CID 83129937
1-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine
CID 60797953
4-fluoro-2-(pyridin-2-ylmethylsulfanyl)aniline
CID 79148713
5-fluoro-1-[(1-methylimidazol-2-yl)methyl]-2,3-dihydroinden-1-ol
CID 116531621
1-(pyridin-2-ylmethyl)cyclobutan-1-ol
CID 79081302

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine?
The IUPAC name of 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine (CID 116532007) is 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine.
What is the SMILES notation for 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine?
The canonical SMILES for 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine is NC1(Cc2ccccn2)CCc2cc(F)ccc21.
What is the InChIKey of 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine?
The InChIKey is AXZSRRCQHXEJCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2/c16-12-4-5-14-11(9-12)6-7-15(14,17)10-13-3-1-2-8-18-13/h1-5,8-9H,6-7,10,17H2.
What are the key properties of 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine?
5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine has a molecular weight of 242.30 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(pyridin-2-ylmethyl)-2,3-dihydroinden-1-amine is sourced from PubChem (CID 116532007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).