N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine

C14H20FN — CID 61066085

IUPACN-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine
SMILESCCNC(Cc1ccc(F)cc1)C1CC1C
InChIInChI=1S/C14H20FN/c1-3-16-14(13-8-10(13)2)9-11-4-6-12(15)7-5-11/h4-7,10,13-14,16H,3,8-9H2,1-2H3
InChIKeyXIZFPCQZKIDMLS-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.00
Rot. Bonds5

About N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine

N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine (PubChem CID 61066085) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine
PubChem CID61066085
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC NameN-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine
SMILESCCNC(Cc1ccc(F)cc1)C1CC1C
InChIInChI=1S/C14H20FN/c1-3-16-14(13-8-10(13)2)9-11-4-6-12(15)7-5-11/h4-7,10,13-14,16H,3,8-9H2,1-2H3
InChIKeyXIZFPCQZKIDMLS-UHFFFAOYSA-N
XLogP3.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2-(4-ethylphenyl)-1-(2-methylcyclopropyl)ethanamine
CID 65422577
N-ethyl-2-(4-fluorophenyl)-1-(3-methyloxolan-2-yl)ethanamine
CID 115786402
N-ethyl-2-(4-fluorophenyl)-1-(3-methylcyclohexyl)ethanamine
CID 63415167
1-cyclooctyl-N-ethyl-2-(4-fluorophenyl)ethanamine
CID 65018192
N-[2-(3-fluorophenyl)-1-(2-methylcyclopropyl)ethyl]propan-1-amine
CID 61064174
1-(1,1-dioxothiolan-3-yl)-N-ethyl-2-(4-fluorophenyl)ethanamine
CID 64905384
N-[2-(4-methoxyphenyl)-1-(2-methylcyclopropyl)ethyl]propan-1-amine
CID 61065705
N-[1-(2-methylcyclopropyl)-2-[4-(trifluoromethoxy)phenyl]ethyl]propan-1-amine
CID 65421078
2-(4-chloro-3-fluorophenyl)-N-ethyl-1-(2-methylcyclopentyl)ethanamine
CID 107892586
N-ethyl-2-(4-fluoro-2-methylphenyl)-1-(2-methylcyclopentyl)ethanamine
CID 107191349
1-(3,4-dimethylcyclohexyl)-2-(4-fluorophenyl)-N-methylethanamine
CID 64739642
N-[(5-fluoro-2-methylphenyl)-(2-methylcyclopropyl)methyl]ethanamine
CID 65419979

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine?
The IUPAC name of N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine (CID 61066085) is N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine?
The canonical SMILES for N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine is CCNC(Cc1ccc(F)cc1)C1CC1C.
What is the InChIKey of N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine?
The InChIKey is XIZFPCQZKIDMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-3-16-14(13-8-10(13)2)9-11-4-6-12(15)7-5-11/h4-7,10,13-14,16H,3,8-9H2,1-2H3.
What are the key properties of N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine?
N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine has a molecular weight of 221.32 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-fluorophenyl)-1-(2-methylcyclopropyl)ethanamine is sourced from PubChem (CID 61066085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).