N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine

C14H23NO3 — CID 55077843

IUPACN-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1coc(COCC2CCCO2)c1
InChIInChI=1S/C14H23NO3/c1-11(2)15-7-12-6-14(18-8-12)10-16-9-13-4-3-5-17-13/h6,8,11,13,15H,3-5,7,9-10H2,1-2H3
InChIKeyQHMVXOYVLVFXEH-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.47
Rot. Bonds7

About N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine

N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine (PubChem CID 55077843) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
PubChem CID55077843
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC NameN-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
SMILESCC(C)NCc1coc(COCC2CCCO2)c1
InChIInChI=1S/C14H23NO3/c1-11(2)15-7-12-6-14(18-8-12)10-16-9-13-4-3-5-17-13/h6,8,11,13,15H,3-5,7,9-10H2,1-2H3
InChIKeyQHMVXOYVLVFXEH-UHFFFAOYSA-N
XLogP2.47
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-1-amine
CID 62443834
N-[[5-(oxan-2-ylmethoxymethyl)thiophen-2-yl]methyl]propan-2-amine
CID 107558038
N-[[3,5-dimethyl-4-(oxolan-2-ylmethoxy)phenyl]methyl]propan-2-amine
CID 43276802
N-[2-[4-(oxolan-2-ylmethoxymethyl)phenyl]ethyl]propan-2-amine
CID 105349489
N,N,2-trimethyl-1-[[4-[(propan-2-ylamino)methyl]furan-2-yl]methoxy]propan-2-amine
CID 79679317
1-[5-(cycloheptylmethoxymethyl)furan-3-yl]-N-methylmethanamine
CID 114248858
N-[[6-(oxolan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62291428
N-[[5-(1,1,1-trifluoropropan-2-yloxymethyl)furan-3-yl]methyl]propan-2-amine
CID 66274882
N-[[5-(3-phenylprop-2-enoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 76943780
N-[[5-[(2,4-dimethylphenoxy)methyl]furan-3-yl]methyl]propan-2-amine
CID 62454677
N-[[5-(propan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62456702
N-[[3-methoxy-4-(oxan-2-ylmethoxy)phenyl]methyl]propan-2-amine
CID 43591754

Frequently Asked Questions

What is the IUPAC name of N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine (CID 55077843) is N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine is CC(C)NCc1coc(COCC2CCCO2)c1.
What is the InChIKey of N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine?
The InChIKey is QHMVXOYVLVFXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-11(2)15-7-12-6-14(18-8-12)10-16-9-13-4-3-5-17-13/h6,8,11,13,15H,3-5,7,9-10H2,1-2H3.
What are the key properties of N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine?
N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine has a molecular weight of 253.34 g/mol, XLogP of 2.47, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 55077843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).