(6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine

C14H20FNO — CID 84700187

IUPAC(6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine
SMILESCC(C)OC1(CN)CCCc2cc(F)ccc21
InChIInChI=1S/C14H20FNO/c1-10(2)17-14(9-16)7-3-4-11-8-12(15)5-6-13(11)14/h5-6,8,10H,3-4,7,9,16H2,1-2H3
InChIKeyZRSHDDUYOYBCPR-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.74
Rot. Bonds3

About (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine

(6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine (PubChem CID 84700187) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine.

Molecular Properties

Compound Name(6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine
PubChem CID84700187
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name(6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine
SMILESCC(C)OC1(CN)CCCc2cc(F)ccc21
InChIInChI=1S/C14H20FNO/c1-10(2)17-14(9-16)7-3-4-11-8-12(15)5-6-13(11)14/h5-6,8,10H,3-4,7,9,16H2,1-2H3
InChIKeyZRSHDDUYOYBCPR-UHFFFAOYSA-N
XLogP2.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[1-(aminomethyl)-5-fluoro-2,3-dihydroinden-1-yl]oxy]ethanol
CID 103376919
2-[[1-(aminomethyl)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]oxy]ethanol
CID 103376928
(4S)-7-fluoro-4-methyl-4-phenyl-2,3-dihydro-1H-naphthalene
CID 137495957
(6-fluoro-1-propan-2-yl-3,4-dihydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate
CID 89475140
(6-fluoro-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84718266
8-(aminomethyl)-8-methoxy-6,7-dihydro-5H-naphthalen-2-ol
CID 105460560
6-fluorospiro[1,2-dihydroindene-3,2'-oxirane]
CID 116532256
1-ethyl-5-fluoro-2,3-dihydroinden-1-ol
CID 59340428
(6-fluorospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-yl)methanamine
CID 115057321
[1-(6-fluoro-2,3-dihydroindol-1-yl)-3-propan-2-ylcyclohexyl]methanamine
CID 107449256
(6-fluoro-1-methyl-3,4-dihydro-2H-naphthalen-1-yl) 2-methylprop-2-enoate
CID 89475138
5-fluoro-1-(4-propylphenyl)-2,3-dihydroinden-1-ol
CID 116531708

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine?
The IUPAC name of (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine (CID 84700187) is (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine.
What is the SMILES notation for (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine?
The canonical SMILES for (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine is CC(C)OC1(CN)CCCc2cc(F)ccc21.
What is the InChIKey of (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine?
The InChIKey is ZRSHDDUYOYBCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-10(2)17-14(9-16)7-3-4-11-8-12(15)5-6-13(11)14/h5-6,8,10H,3-4,7,9,16H2,1-2H3.
What are the key properties of (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine?
(6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine has a molecular weight of 237.32 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-1-propan-2-yloxy-3,4-dihydro-2H-naphthalen-1-yl)methanamine is sourced from PubChem (CID 84700187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).