N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine

C16H24FNO — CID 103556929

IUPACN-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine
SMILESCCNC(Cc1cccc(F)c1)CC1(OC)CCC1
InChIInChI=1S/C16H24FNO/c1-3-18-15(12-16(19-2)8-5-9-16)11-13-6-4-7-14(17)10-13/h4,6-7,10,15,18H,3,5,8-9,11-12H2,1-2H3
InChIKeySDTFBESDQJDSBT-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.31
Rot. Bonds7

About N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine

N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine (PubChem CID 103556929) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine
PubChem CID103556929
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC NameN-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine
SMILESCCNC(Cc1cccc(F)c1)CC1(OC)CCC1
InChIInChI=1S/C16H24FNO/c1-3-18-15(12-16(19-2)8-5-9-16)11-13-6-4-7-14(17)10-13/h4,6-7,10,15,18H,3,5,8-9,11-12H2,1-2H3
InChIKeySDTFBESDQJDSBT-UHFFFAOYSA-N
XLogP3.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-difluorophenyl)-3-(1-methoxycyclobutyl)-N-propylpropan-2-amine
CID 103556973
1-(2,5-dimethylphenyl)-N-ethyl-3-(1-methoxycyclobutyl)propan-2-amine
CID 103556957
1-(3-chlorophenyl)-N-ethyl-3-(3-fluorophenyl)propan-2-amine
CID 60819525
2-N-ethyl-3-(3-fluorophenyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 79093303
1-(1-ethoxycyclohexyl)-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 116764071
N-ethyl-1-(3-fluorophenyl)-4-methylhexan-2-amine
CID 62602319
1-[1-(ethylamino)-2-(3-fluorophenyl)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79070691
1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 103559792
1-(3-bromo-5-fluorophenyl)-N-ethyl-3-(3-fluorophenyl)propan-2-amine
CID 79699790
N-ethyl-1-(3-fluorophenyl)-6-methylheptan-2-amine
CID 83161562
N-ethyl-1-(1-methoxycyclobutyl)-3-(5-methyl-2-pyridinyl)propan-2-amine
CID 103557054
[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
CID 103560538

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine?
The IUPAC name of N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine (CID 103556929) is N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine.
What is the SMILES notation for N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine?
The canonical SMILES for N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine is CCNC(Cc1cccc(F)c1)CC1(OC)CCC1.
What is the InChIKey of N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine?
The InChIKey is SDTFBESDQJDSBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-3-18-15(12-16(19-2)8-5-9-16)11-13-6-4-7-14(17)10-13/h4,6-7,10,15,18H,3,5,8-9,11-12H2,1-2H3.
What are the key properties of N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine?
N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine has a molecular weight of 265.37 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine is sourced from PubChem (CID 103556929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).