N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine

C15H15FN2O — CID 43283717

IUPACN-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine
SMILESFc1cc(CNC2CC2)ccc1Oc1cccnc1
InChIInChI=1S/C15H15FN2O/c16-14-8-11(9-18-12-4-5-12)3-6-15(14)19-13-2-1-7-17-10-13/h1-3,6-8,10,12,18H,4-5,9H2
InChIKeyRGUCQFIUCCDXSN-UHFFFAOYSA-N
MW258.30 g/mol
LogP3.27
Rot. Bonds5

About N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine

N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine (PubChem CID 43283717) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine
PubChem CID43283717
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC NameN-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine
SMILESFc1cc(CNC2CC2)ccc1Oc1cccnc1
InChIInChI=1S/C15H15FN2O/c16-14-8-11(9-18-12-4-5-12)3-6-15(14)19-13-2-1-7-17-10-13/h1-3,6-8,10,12,18H,4-5,9H2
InChIKeyRGUCQFIUCCDXSN-UHFFFAOYSA-N
XLogP3.27
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-fluoro-4-phenoxyphenyl)methyl]cyclopropanamine
CID 43283191
N-[[4-[(5-chloro-3-pyridinyl)oxy]-3-fluorophenyl]methyl]cyclopropanamine
CID 64601004
N-[[3-fluoro-4-[(6-methyl-3-pyridinyl)oxy]phenyl]methyl]cyclopropanamine
CID 62072927
N-[[3-fluoro-4-(4-fluorophenoxy)phenyl]methyl]cyclopropanamine
CID 43283164
N-[[3-fluoro-4-(3-iodophenoxy)phenyl]methyl]cyclopropanamine
CID 43283686
N'-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl)-N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]oxamide
CID 166195405
N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]-6,6-dimethyl-1,4,5,7-tetrahydrobenzimidazol-4-amine
CID 167872661
N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]-2-pyridin-3-yloxyacetamide
CID 166189097
N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]-1,4,5,6-tetrahydropyrimidin-2-amine
CID 110918435
N-[[3-fluoro-4-(2-fluoro-3-methylphenoxy)phenyl]methyl]cyclopropanamine
CID 107659574
N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 119864556
N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]quinolin-2-amine
CID 133274441

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine?
The IUPAC name of N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine (CID 43283717) is N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine?
The canonical SMILES for N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine is Fc1cc(CNC2CC2)ccc1Oc1cccnc1.
What is the InChIKey of N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine?
The InChIKey is RGUCQFIUCCDXSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O/c16-14-8-11(9-18-12-4-5-12)3-6-15(14)19-13-2-1-7-17-10-13/h1-3,6-8,10,12,18H,4-5,9H2.
What are the key properties of N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine?
N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine has a molecular weight of 258.30 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluoro-4-pyridin-3-yloxyphenyl)methyl]cyclopropanamine is sourced from PubChem (CID 43283717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).