[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine

C16H22FNO — CID 117413291

IUPAC[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
SMILESNCC1(c2c(F)ccc3c2OCCC3)CCCCC1
InChIInChI=1S/C16H22FNO/c17-13-7-6-12-5-4-10-19-15(12)14(13)16(11-18)8-2-1-3-9-16/h6-7H,1-5,8-11,18H2
InChIKeyREPVYELYHYYEFR-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.31
Rot. Bonds2

About [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine

[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine (PubChem CID 117413291) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
PubChem CID117413291
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC Name[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
SMILESNCC1(c2c(F)ccc3c2OCCC3)CCCCC1
InChIInChI=1S/C16H22FNO/c17-13-7-6-12-5-4-10-19-15(12)14(13)16(11-18)8-2-1-3-9-16/h6-7H,1-5,8-11,18H2
InChIKeyREPVYELYHYYEFR-UHFFFAOYSA-N
XLogP3.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclopropyl]methanamine
CID 117315960
[1-(7-fluoro-3,4-dihydro-2H-1,5-benzodioxepin-6-yl)cyclopentyl]methanamine
CID 117417446
[1-(2,6-difluorophenyl)cyclopentyl]methanamine
CID 47002854
[1-(5-fluoro-2,3-dihydro-1,4-benzodioxin-8-yl)cyclobutyl]methanamine
CID 117346634
1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine
CID 117295877
2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol
CID 117301278
[1-(2,6-difluoro-3-methylphenyl)cyclopentyl]methanamine
CID 117323755
(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
CID 130845713
8-bromo-7-fluoro-3,4-dihydro-2H-chromene
CID 155778553
7-fluoro-3,4-dihydro-2H-chromen-8-ol
CID 10630931
[1-(7-fluoro-6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)cyclohexyl]methanamine
CID 117476076
[1-(4-chloro-2,6-difluorophenyl)cyclopentyl]methanamine
CID 117366660

Frequently Asked Questions

What is the IUPAC name of [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine?
The IUPAC name of [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine (CID 117413291) is [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine?
The canonical SMILES for [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine is NCC1(c2c(F)ccc3c2OCCC3)CCCCC1.
What is the InChIKey of [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine?
The InChIKey is REPVYELYHYYEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c17-13-7-6-12-5-4-10-19-15(12)14(13)16(11-18)8-2-1-3-9-16/h6-7H,1-5,8-11,18H2.
What are the key properties of [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine?
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine has a molecular weight of 263.36 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine is sourced from PubChem (CID 117413291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).