N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine

C14H21NO2 — CID 62999058

IUPACN-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine
SMILESc1coc(CC2(CNC3CC3)CCOCC2)c1
InChIInChI=1S/C14H21NO2/c1-2-13(17-7-1)10-14(5-8-16-9-6-14)11-15-12-3-4-12/h1-2,7,12,15H,3-6,8-11H2
InChIKeyIRKNAFYRARCVSX-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.37
Rot. Bonds5

About N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine

N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine (PubChem CID 62999058) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine
PubChem CID62999058
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine
SMILESc1coc(CC2(CNC3CC3)CCOCC2)c1
InChIInChI=1S/C14H21NO2/c1-2-13(17-7-1)10-14(5-8-16-9-6-14)11-15-12-3-4-12/h1-2,7,12,15H,3-6,8-11H2
InChIKeyIRKNAFYRARCVSX-UHFFFAOYSA-N
XLogP2.37
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(furan-2-ylmethyl)cyclopropyl]methyl]cyclopropanamine
CID 66024468
N-[[4-[(4-fluorophenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62906105
N-[[4-[(2-methylphenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62906269
N-[[3-(furan-2-ylmethyl)oxolan-3-yl]methyl]propan-1-amine
CID 62997767
[3-(furan-2-ylmethyl)oxolan-3-yl]methanol
CID 66059212
N-[[4-[(3-methoxyphenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62905211
N-[[4-[(4-chloro-3-fluorophenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 107897466
N-[[4-[(2,4-difluorophenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62906967
N-[[4-(1,3-benzothiazol-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine
CID 104631888
N-[[3-[(4-fluorophenyl)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 62718679
N-[(1-benzylcyclopropyl)methyl]cyclopropanamine
CID 66026239
N-[[4-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391480

Frequently Asked Questions

What is the IUPAC name of N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine (CID 62999058) is N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine is c1coc(CC2(CNC3CC3)CCOCC2)c1.
What is the InChIKey of N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine?
The InChIKey is IRKNAFYRARCVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-13(17-7-1)10-14(5-8-16-9-6-14)11-15-12-3-4-12/h1-2,7,12,15H,3-6,8-11H2.
What are the key properties of N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine?
N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine has a molecular weight of 235.33 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(furan-2-ylmethyl)oxan-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62999058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).