N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine

C14H13FN2 — CID 115591065

IUPACN-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine
SMILESFc1cccc(NC2CCc3ccccc32)n1
InChIInChI=1S/C14H13FN2/c15-13-6-3-7-14(17-13)16-12-9-8-10-4-1-2-5-11(10)12/h1-7,12H,8-9H2,(H,16,17)
InChIKeyBENHEYJBPDGEOG-UHFFFAOYSA-N
MW228.27 g/mol
LogP3.32
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine

N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine (PubChem CID 115591065) has the molecular formula C14H13FN2 and a molecular weight of 228.27 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine
PubChem CID115591065
Molecular FormulaC14H13FN2
Molecular Weight228.27 g/mol
Exact Mass228.11
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine
SMILESFc1cccc(NC2CCc3ccccc32)n1
InChIInChI=1S/C14H13FN2/c15-13-6-3-7-14(17-13)16-12-9-8-10-4-1-2-5-11(10)12/h1-7,12H,8-9H2,(H,16,17)
InChIKeyBENHEYJBPDGEOG-UHFFFAOYSA-N
XLogP3.32
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine
CID 115756197
6-methoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine
CID 63590242
6-bromo-N-(2,3-dihydro-1H-inden-1-yl)quinolin-2-amine
CID 68914486
5-(2-chlorophenyl)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]quinolin-2-amine
CID 25016500
(3,5-difluorophenyl)-[2-(2,3-dihydro-1H-inden-1-ylamino)quinolin-5-yl]methanone
CID 77225077
5-chloro-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyrazin-2-amine
CID 169260324
5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine
CID 169260360
N-(2,6-dibromophenyl)-2,3-dihydro-1H-inden-1-amine
CID 107597542
N-(6-fluoro-2-pyridinyl)-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 113234559
N-(2,6-dichloro-4-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 83077299
2-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-5-fluoropyrimidine-2,4-diamine
CID 141199441
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-5-(4-fluorobenzenecarboximidoyl)quinolin-2-amine
CID 86620841

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine (CID 115591065) is N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine is Fc1cccc(NC2CCc3ccccc32)n1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine?
The InChIKey is BENHEYJBPDGEOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2/c15-13-6-3-7-14(17-13)16-12-9-8-10-4-1-2-5-11(10)12/h1-7,12H,8-9H2,(H,16,17).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine?
N-(2,3-dihydro-1H-inden-1-yl)-6-fluoropyridin-2-amine has a molecular weight of 228.27 g/mol, XLogP of 3.32, 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)-6-fluoropyridin-2-amine is sourced from PubChem (CID 115591065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).