2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol

C20H28N2O3 — CID 75377692

IUPAC2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol
SMILESOC(CN(CCCN1CCOCC1)Cc1ccccc1)c1ccco1
InChIInChI=1S/C20H28N2O3/c23-19(20-8-4-13-25-20)17-22(16-18-6-2-1-3-7-18)10-5-9-21-11-14-24-15-12-21/h1-4,6-8,13,19,23H,5,9-12,14-17H2
InChIKeyUGACOZCQVJCCSE-UHFFFAOYSA-N
MW344.45 g/mol
LogP2.54
Rot. Bonds9

About 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol

2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol (PubChem CID 75377692) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol.

Molecular Properties

Compound Name2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol
PubChem CID75377692
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC Name2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol
SMILESOC(CN(CCCN1CCOCC1)Cc1ccccc1)c1ccco1
InChIInChI=1S/C20H28N2O3/c23-19(20-8-4-13-25-20)17-22(16-18-6-2-1-3-7-18)10-5-9-21-11-14-24-15-12-21/h1-4,6-8,13,19,23H,5,9-12,14-17H2
InChIKeyUGACOZCQVJCCSE-UHFFFAOYSA-N
XLogP2.54
TPSA49.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[benzyl-[2-(furan-2-yl)-2-hydroxyethyl]amino]propanoic acid
CID 119152156
(2S)-1-[benzyl(2-morpholin-4-ylethyl)amino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 93161388
(1R)-2-[benzyl(pyridin-4-ylmethyl)amino]-1-(furan-2-yl)ethanol
CID 97082119
N'-benzyl-N'-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 107367226
(2R)-1-[benzyl-[2-(furan-2-yl)-2-hydroxyethyl]amino]butan-2-ol
CID 111970128
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-2-methyl-N-(3-morpholin-4-ylpropyl)propanamide
CID 4990910
(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol
CID 93162213
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-3-methyl-N-(3-morpholin-4-ylpropyl)butanamide
CID 3488894
4-[[3-morpholin-4-ylpropyl(pyridin-3-ylmethyl)amino]methyl]phenol
CID 46961418
(2R)-1-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenoxypropan-2-ol
CID 93163691
N-[furan-2-yl(phenyl)methyl]-2-morpholin-4-ylethanamine
CID 43178931
(2R)-1-[benzyl-[(2S)-2-(furan-2-yl)-2-hydroxyethyl]amino]-4-ethoxybutan-2-ol
CID 100668034

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol?
The IUPAC name of 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol (CID 75377692) is 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol.
What is the SMILES notation for 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol?
The canonical SMILES for 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol is OC(CN(CCCN1CCOCC1)Cc1ccccc1)c1ccco1.
What is the InChIKey of 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol?
The InChIKey is UGACOZCQVJCCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c23-19(20-8-4-13-25-20)17-22(16-18-6-2-1-3-7-18)10-5-9-21-11-14-24-15-12-21/h1-4,6-8,13,19,23H,5,9-12,14-17H2.
What are the key properties of 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol?
2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol has a molecular weight of 344.45 g/mol, XLogP of 2.54, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(3-morpholin-4-ylpropyl)amino]-1-(furan-2-yl)ethanol is sourced from PubChem (CID 75377692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).