(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

C17H24FN — CID 115057911

IUPAC(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESNCC1CCc2ccc(F)cc2C1C1CCCCC1
InChIInChI=1S/C17H24FN/c18-15-9-8-12-6-7-14(11-19)17(16(12)10-15)13-4-2-1-3-5-13/h8-10,13-14,17H,1-7,11,19H2
InChIKeyKZWZVHAIJOMIFI-UHFFFAOYSA-N
MW261.38 g/mol
LogP4.01
Rot. Bonds2

About (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 115057911) has the molecular formula C17H24FN and a molecular weight of 261.38 g/mol. Its IUPAC name is (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
PubChem CID115057911
Molecular FormulaC17H24FN
Molecular Weight261.38 g/mol
Exact Mass261.19
IUPAC Name(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESNCC1CCc2ccc(F)cc2C1C1CCCCC1
InChIInChI=1S/C17H24FN/c18-15-9-8-12-6-7-14(11-19)17(16(12)10-15)13-4-2-1-3-5-13/h8-10,13-14,17H,1-7,11,19H2
InChIKeyKZWZVHAIJOMIFI-UHFFFAOYSA-N
XLogP4.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.38
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(7-bromo-1-cyclopentyl-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 115057906
(1-cyclopentyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 115057908
(6-fluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 82074741
1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 115057986
(7-fluoro-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 83907571
2-amino-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-ol;hydrochloride
CID 71432297
[(3R,4R)-1-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-4-phenylpyrrolidin-3-yl]methanamine
CID 120759825
2-cyclohexyl-4-fluoroaniline
CID 15335253
[(7S)-4-fluoro-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methanamine
CID 98041428
(6-fluorospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-yl)methanamine
CID 115057321
[2-(5-fluoro-2-methoxyphenyl)cyclohexyl]methanamine
CID 82782278
2-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)-methylamino]acetamide
CID 154740189

Frequently Asked Questions

What is the IUPAC name of (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (CID 115057911) is (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is NCC1CCc2ccc(F)cc2C1C1CCCCC1.
What is the InChIKey of (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is KZWZVHAIJOMIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN/c18-15-9-8-12-6-7-14(11-19)17(16(12)10-15)13-4-2-1-3-5-13/h8-10,13-14,17H,1-7,11,19H2.
What are the key properties of (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
(1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 261.38 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclohexyl-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 115057911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).