N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine

C11H17NO2 — CID 63001698

IUPACN-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine
SMILESc1cc(CNCC2CCCOC2)co1
InChIInChI=1S/C11H17NO2/c1-2-10(8-13-4-1)6-12-7-11-3-5-14-9-11/h3,5,9-10,12H,1-2,4,6-8H2
InChIKeyAZVGQTAYEIWRGA-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.80
Rot. Bonds4

About N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine

N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine (PubChem CID 63001698) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine
PubChem CID63001698
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine
SMILESc1cc(CNCC2CCCOC2)co1
InChIInChI=1S/C11H17NO2/c1-2-10(8-13-4-1)6-12-7-11-3-5-14-9-11/h3,5,9-10,12H,1-2,4,6-8H2
InChIKeyAZVGQTAYEIWRGA-UHFFFAOYSA-N
XLogP1.80
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-cyclopropylphenyl)methyl]-1-(oxan-3-yl)methanamine
CID 79978645
N-(furan-3-ylmethyl)-1-(oxolan-2-yl)methanamine
CID 3156818
N-[(3,4-dichlorophenyl)methyl]-1-(oxan-3-yl)methanamine
CID 54906440
N-[(3,4-dimethylphenyl)methyl]-1-(oxan-3-yl)methanamine
CID 54906123
1-(oxan-3-yl)-N-[(3,4,5-trifluorophenyl)methyl]methanamine
CID 55147927
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(oxan-3-yl)methanamine
CID 54906782
1-[(3S)-oxan-3-yl]-N-[[(3S)-oxan-3-yl]methyl]methanamine
CID 129371205
1-(4,4-dimethylcyclohexyl)-N-(furan-3-ylmethyl)methanamine
CID 115774680
N,N-diethyl-4-[(oxan-3-ylmethylamino)methyl]aniline
CID 61019907
[5-[(oxan-3-ylmethylamino)methyl]furan-2-yl]methanol
CID 64590655
N-[(3-bromo-4-chlorophenyl)methyl]-1-(oxan-3-yl)methanamine
CID 83235438
1-cyclopentyl-N-(oxan-3-ylmethyl)methanamine
CID 61342622

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine?
The IUPAC name of N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine (CID 63001698) is N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine.
What is the SMILES notation for N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine?
The canonical SMILES for N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine is c1cc(CNCC2CCCOC2)co1.
What is the InChIKey of N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine?
The InChIKey is AZVGQTAYEIWRGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-2-10(8-13-4-1)6-12-7-11-3-5-14-9-11/h3,5,9-10,12H,1-2,4,6-8H2.
What are the key properties of N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine?
N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine has a molecular weight of 195.26 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-1-(oxan-3-yl)methanamine is sourced from PubChem (CID 63001698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).