N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine

C14H15NO — CID 63948734

IUPACN-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine
SMILESc1ccc(-c2ccoc2)c(CNC2CC2)c1
InChIInChI=1S/C14H15NO/c1-2-4-14(12-7-8-16-10-12)11(3-1)9-15-13-5-6-13/h1-4,7-8,10,13,15H,5-6,9H2
InChIKeyHOSFCWPMLNVRNL-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.20
Rot. Bonds4

About N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine

N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine (PubChem CID 63948734) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine
PubChem CID63948734
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC NameN-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine
SMILESc1ccc(-c2ccoc2)c(CNC2CC2)c1
InChIInChI=1S/C14H15NO/c1-2-4-14(12-7-8-16-10-12)11(3-1)9-15-13-5-6-13/h1-4,7-8,10,13,15H,5-6,9H2
InChIKeyHOSFCWPMLNVRNL-UHFFFAOYSA-N
XLogP3.20
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(furan-3-yl)-4,5-dimethoxyphenyl]methyl]cyclopropanamine
CID 63949144
3-(2-ethylphenyl)furan
CID 146186542
N-[[2-(2,3,5,6-tetrachlorophenyl)phenyl]methyl]cyclopropanamine
CID 63424961
N-[[2-(2,4,6-trichlorophenyl)phenyl]methyl]cyclopropanamine
CID 105350078
N-[[2-(4-propan-2-yloxyphenyl)phenyl]methyl]cyclopropanamine
CID 61034453
N-[[2-(2,4,5-trifluorophenyl)phenyl]methyl]cyclopropanamine
CID 115503138
N-[[2-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)phenyl]methyl]cyclopropanamine
CID 61032911
N-[[2-(2-ethoxyphenyl)phenyl]methyl]cyclopropanamine
CID 62801536
N-[[2-(2-chloro-4,5-dimethylphenyl)phenyl]methyl]cyclopropanamine
CID 115484384
(1S,5R)-3-[[2-(furan-3-yl)phenyl]methoxy]-8-azabicyclo[3.2.1]octane;hydrochloride
CID 68676795
N-[[2-(2-chloro-4-fluorophenyl)phenyl]methyl]cyclopropanamine
CID 115504969
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]cyclopropanamine
CID 62439214

Frequently Asked Questions

What is the IUPAC name of N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine (CID 63948734) is N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine is c1ccc(-c2ccoc2)c(CNC2CC2)c1.
What is the InChIKey of N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine?
The InChIKey is HOSFCWPMLNVRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-2-4-14(12-7-8-16-10-12)11(3-1)9-15-13-5-6-13/h1-4,7-8,10,13,15H,5-6,9H2.
What are the key properties of N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine?
N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine has a molecular weight of 213.28 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(furan-3-yl)phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 63948734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).