1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol

C9H15NO3 — CID 2771927

IUPAC1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol
SMILESCNCC(O)COCc1ccco1
InChIInChI=1S/C9H15NO3/c1-10-5-8(11)6-12-7-9-3-2-4-13-9/h2-4,8,10-11H,5-7H2,1H3
InChIKeyQAARPPXWXOTLQO-UHFFFAOYSA-N
MW185.22 g/mol
LogP0.38
Rot. Bonds6

About 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol

1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol (PubChem CID 2771927) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol.

Molecular Properties

Compound Name1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol
PubChem CID2771927
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC Name1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol
SMILESCNCC(O)COCc1ccco1
InChIInChI=1S/C9H15NO3/c1-10-5-8(11)6-12-7-9-3-2-4-13-9/h2-4,8,10-11H,5-7H2,1H3
InChIKeyQAARPPXWXOTLQO-UHFFFAOYSA-N
XLogP0.38
TPSA54.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,2-dimethylhydrazinyl)-3-(furan-2-ylmethoxy)propan-2-ol
CID 83014158
1-(furan-2-ylmethoxy)-3-(2-methoxyethoxyamino)propan-2-ol
CID 82721549
1-(furan-2-ylmethoxy)-3-(prop-2-ynylamino)propan-2-ol
CID 60649357
4-[[3-(furan-2-ylmethoxy)-2-hydroxypropyl]amino]pentan-2-ol
CID 113376215
1-(furan-2-ylmethoxy)-3-(4-methylanilino)propan-2-ol
CID 60899568
1-(furan-2-ylmethoxy)-3-(pentylamino)propan-2-ol
CID 60633241
1-[2-(dimethylamino)ethylamino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 60635601
1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol
CID 62397757
(2R)-1-(furan-2-ylmethoxy)-3-(prop-2-enylamino)propan-2-ol
CID 93381179
1-(furan-2-ylmethoxy)-3-(4-iodoanilino)propan-2-ol
CID 60901372
1-(furan-2-ylmethoxy)-3-[(4-methylcyclohexyl)amino]propan-2-ol
CID 60633413
2-[[3-(furan-2-ylmethoxy)-2-hydroxypropyl]amino]-4-methylpentan-1-ol
CID 61245995

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol?
The IUPAC name of 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol (CID 2771927) is 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol.
What is the SMILES notation for 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol?
The canonical SMILES for 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol is CNCC(O)COCc1ccco1.
What is the InChIKey of 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol?
The InChIKey is QAARPPXWXOTLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c1-10-5-8(11)6-12-7-9-3-2-4-13-9/h2-4,8,10-11H,5-7H2,1H3.
What are the key properties of 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol?
1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol has a molecular weight of 185.22 g/mol, XLogP of 0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol is sourced from PubChem (CID 2771927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).