1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol

C14H23NO4 — CID 54938663

IUPAC1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
SMILESCC(NCC(O)COCC1CCCO1)c1ccco1
InChIInChI=1S/C14H23NO4/c1-11(14-5-3-7-19-14)15-8-12(16)9-17-10-13-4-2-6-18-13/h3,5,7,11-13,15-16H,2,4,6,8-10H2,1H3
InChIKeyMYAJCHMIRCFXHI-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.49
Rot. Bonds8

About 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol

1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol (PubChem CID 54938663) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
PubChem CID54938663
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC Name1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
SMILESCC(NCC(O)COCC1CCCO1)c1ccco1
InChIInChI=1S/C14H23NO4/c1-11(14-5-3-7-19-14)15-8-12(16)9-17-10-13-4-2-6-18-13/h3,5,7,11-13,15-16H,2,4,6,8-10H2,1H3
InChIKeyMYAJCHMIRCFXHI-UHFFFAOYSA-N
XLogP1.49
TPSA63.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(5-methylfuran-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 61040225
1-[[(1R)-1-(2-methylphenyl)ethyl]amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 81364457
1-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 81355892
1-[1-(3-bromophenyl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 60746205
1-[1-(5-methylthiophen-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 61473596
1-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 78839356
3-[[2-hydroxy-3-(oxolan-2-ylmethoxy)propyl]amino]butan-1-ol
CID 83177777
1-(2-ethoxyethoxy)-3-[1-(furan-2-yl)ethylamino]propan-2-ol
CID 54938711
1-(furan-2-yl)-N-(oxan-2-ylmethyl)ethanamine
CID 43403758
2-[[2-hydroxy-3-(oxolan-2-ylmethoxy)propyl]amino]-N-methylpropanamide
CID 54950771
1-cyclopentyl-3-[[(1S)-1-(furan-2-yl)ethyl]amino]propan-2-ol
CID 103158136
1-[1-(furan-2-yl)ethylamino]-3-(3-methylcyclohexyl)oxypropan-2-ol
CID 60909613

Frequently Asked Questions

What is the IUPAC name of 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
The IUPAC name of 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol (CID 54938663) is 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol.
What is the SMILES notation for 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
The canonical SMILES for 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol is CC(NCC(O)COCC1CCCO1)c1ccco1.
What is the InChIKey of 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
The InChIKey is MYAJCHMIRCFXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-11(14-5-3-7-19-14)15-8-12(16)9-17-10-13-4-2-6-18-13/h3,5,7,11-13,15-16H,2,4,6,8-10H2,1H3.
What are the key properties of 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol has a molecular weight of 269.34 g/mol, XLogP of 1.49, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(furan-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol is sourced from PubChem (CID 54938663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).