[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine

C11H17NO3 — CID 62444972

IUPAC[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine
SMILESNCc1occc1COCC1CCCO1
InChIInChI=1S/C11H17NO3/c12-6-11-9(3-5-15-11)7-13-8-10-2-1-4-14-10/h3,5,10H,1-2,4,6-8,12H2
InChIKeyBJJCXAQFRUIJMI-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.43
Rot. Bonds5

About [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine

[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine (PubChem CID 62444972) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine.

Molecular Properties

Compound Name[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine
PubChem CID62444972
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine
SMILESNCc1occc1COCC1CCCO1
InChIInChI=1S/C11H17NO3/c12-6-11-9(3-5-15-11)7-13-8-10-2-1-4-14-10/h3,5,10H,1-2,4,6-8,12H2
InChIKeyBJJCXAQFRUIJMI-UHFFFAOYSA-N
XLogP1.43
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62443550
N-[[2-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444616
2-methyl-N-[[2-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 62444617
2,3-bis(oxiran-2-ylmethoxymethyl)furan
CID 176654552
2-methyl-N-[[2-(oxan-2-ylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 62444899
2-[[(2S)-oxolan-2-yl]methoxymethyl]benzenethiol
CID 97294081
2-(oxolan-2-ylmethoxymethyl)benzonitrile
CID 24702281
[3-(oxan-2-ylmethoxymethyl)-2-pyridinyl]methanamine
CID 62895887
[(2S)-oxolan-2-yl]methoxymethanamine
CID 126553312
[5-methyl-4-(oxan-2-ylmethoxymethyl)furan-2-yl]methanamine
CID 62445276
7-(oxolan-2-ylmethoxymethyl)-2,3-dihydro-1,4-benzodioxin-6-amine
CID 43260036
[4-(oxolan-2-ylmethoxymethyl)-1,3-thiazol-2-yl]methanamine
CID 62443830

Frequently Asked Questions

What is the IUPAC name of [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine?
The IUPAC name of [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine (CID 62444972) is [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine.
What is the SMILES notation for [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine?
The canonical SMILES for [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine is NCc1occc1COCC1CCCO1.
What is the InChIKey of [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine?
The InChIKey is BJJCXAQFRUIJMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c12-6-11-9(3-5-15-11)7-13-8-10-2-1-4-14-10/h3,5,10H,1-2,4,6-8,12H2.
What are the key properties of [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine?
[3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine has a molecular weight of 211.26 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(oxolan-2-ylmethoxymethyl)furan-2-yl]methanamine is sourced from PubChem (CID 62444972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).