1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol

C12H19NO3 — CID 62397757

IUPAC1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol
SMILESCC1CC1NCC(O)COCc1ccco1
InChIInChI=1S/C12H19NO3/c1-9-5-12(9)13-6-10(14)7-15-8-11-3-2-4-16-11/h2-4,9-10,12-14H,5-8H2,1H3
InChIKeyMRXJULAVEICFBP-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.16
Rot. Bonds7

About 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol

1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol (PubChem CID 62397757) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol
PubChem CID62397757
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol
SMILESCC1CC1NCC(O)COCc1ccco1
InChIInChI=1S/C12H19NO3/c1-9-5-12(9)13-6-10(14)7-15-8-11-3-2-4-16-11/h2-4,9-10,12-14H,5-8H2,1H3
InChIKeyMRXJULAVEICFBP-UHFFFAOYSA-N
XLogP1.16
TPSA54.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-ylmethoxy)-3-[(2-methyloxolan-3-yl)amino]propan-2-ol
CID 82726496
1-(furan-2-ylmethoxy)-3-[(4-methylcyclohexyl)amino]propan-2-ol
CID 60633413
1-(furan-2-ylmethoxy)-3-(methylamino)propan-2-ol
CID 2771927
1-(furan-2-ylmethoxy)-3-[(1-methylpyrrolidin-3-yl)amino]propan-2-ol
CID 54949730
1-(2,2-dimethylhydrazinyl)-3-(furan-2-ylmethoxy)propan-2-ol
CID 83014158
1-(furan-2-ylmethoxy)-3-(prop-2-ynylamino)propan-2-ol
CID 60649357
1-[[(1S)-1-cycloheptylethyl]amino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 81388401
1-(furan-2-ylmethoxy)-3-(2-methoxyethoxyamino)propan-2-ol
CID 82721549
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
2-[[3-(furan-2-ylmethoxy)-2-hydroxypropyl]amino]-4-methylpentan-1-ol
CID 61245995
1-[(1,1-dioxothian-3-yl)amino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 63922347

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol?
The IUPAC name of 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol (CID 62397757) is 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol.
What is the SMILES notation for 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol?
The canonical SMILES for 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol is CC1CC1NCC(O)COCc1ccco1.
What is the InChIKey of 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol?
The InChIKey is MRXJULAVEICFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c1-9-5-12(9)13-6-10(14)7-15-8-11-3-2-4-16-11/h2-4,9-10,12-14H,5-8H2,1H3.
What are the key properties of 1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol?
1-(furan-2-ylmethoxy)-3-[(2-methylcyclopropyl)amino]propan-2-ol has a molecular weight of 225.29 g/mol, XLogP of 1.16, 7 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-[(2-methylcyclopropyl)amino]propan-2-ol is sourced from PubChem (CID 62397757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).