5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine

C10H12FNO — CID 55294576

IUPAC5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1c(F)ccc2c1CCC2N
InChIInChI=1S/C10H12FNO/c1-13-10-7-3-5-9(12)6(7)2-4-8(10)11/h2,4,9H,3,5,12H2,1H3
InChIKeyKANPBLWDNPDNKH-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.78
Rot. Bonds1

About 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine

5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine (PubChem CID 55294576) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine
PubChem CID55294576
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1c(F)ccc2c1CCC2N
InChIInChI=1S/C10H12FNO/c1-13-10-7-3-5-9(12)6(7)2-4-8(10)11/h2,4,9H,3,5,12H2,1H3
InChIKeyKANPBLWDNPDNKH-UHFFFAOYSA-N
XLogP1.78
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-6-fluoro-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55268325
(1S)-5-fluoro-4-iodo-2,3-dihydro-1H-inden-1-amine
CID 130871328
4-fluoro-2,3-dihydro-1H-inden-1-amine;methanamine
CID 175262813
6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
CID 83377554
4-chloro-5-methoxy-2,3-dihydro-1H-inden-1-amine
CID 55272709
(1R)-6-fluoro-5-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130740875
(1R)-4-ethyl-5-methoxy-2,3-dihydro-1H-inden-1-amine
CID 130765822
(1S)-4,5-difluoro-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 55272365
(1S)-4,6-dibromo-5-methoxy-2,3-dihydro-1H-inden-1-amine
CID 130706079
(1R)-4-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 134159261
2-(2,4-difluoro-3-methoxyphenyl)-1,3-dioxolane
CID 162421197
1-amino-4-fluoro-2,3-dihydro-1H-indene-5-carbonitrile
CID 55292008

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine (CID 55294576) is 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine is COc1c(F)ccc2c1CCC2N.
What is the InChIKey of 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KANPBLWDNPDNKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c1-13-10-7-3-5-9(12)6(7)2-4-8(10)11/h2,4,9H,3,5,12H2,1H3.
What are the key properties of 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine?
5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine has a molecular weight of 181.21 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 55294576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).