(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide

C23H22N2O4 — CID 2421462

IUPAC(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)[C@@H](C)Nc1ccccc1CO)oc1ccccc12
InChIInChI=1S/C23H22N2O4/c1-14(24-18-9-5-3-7-15(18)13-26)23(27)25-19-12-21-17(11-22(19)28-2)16-8-4-6-10-20(16)29-21/h3-12,14,24,26H,13H2,1-2H3,(H,25,27)/t14-/m1/s1
InChIKeyFSTIDSDNELCRPX-CQSZACIVSA-N
MW390.44 g/mol
LogP4.53
Rot. Bonds6

About (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide

(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide (PubChem CID 2421462) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide
PubChem CID2421462
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)[C@@H](C)Nc1ccccc1CO)oc1ccccc12
InChIInChI=1S/C23H22N2O4/c1-14(24-18-9-5-3-7-15(18)13-26)23(27)25-19-12-21-17(11-22(19)28-2)16-8-4-6-10-20(16)29-21/h3-12,14,24,26H,13H2,1-2H3,(H,25,27)/t14-/m1/s1
InChIKeyFSTIDSDNELCRPX-CQSZACIVSA-N
XLogP4.53
TPSA83.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(benzylamino)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 2317955
2-(benzylamino)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 4780757
N-(2-methoxydibenzofuran-3-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674201
(2R)-N-(2-methoxydibenzofuran-3-yl)-2-(thiophen-2-ylmethylamino)propanamide
CID 2415110
(2S)-2-[[(1S)-1-(furan-2-yl)ethyl]amino]-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 8920314
[(2S)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 2-(2-methylphenyl)acetate
CID 7489192
1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea
CID 86976519
(2R)-2-[2-(4-fluorophenyl)ethylamino]-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 2402948
[(2S)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl]-methyl-(thiophen-3-ylmethyl)azanium
CID 9054812
(2R)-2-(carbamoylamino)-N-(2-methoxydibenzofuran-3-yl)-3-methylbutanamide
CID 40799365
(2R)-2-(azepan-1-ium-1-yl)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 2462122
[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 2-methoxybenzoate
CID 7811454

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide?
The IUPAC name of (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide (CID 2421462) is (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide.
What is the SMILES notation for (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide?
The canonical SMILES for (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide is COc1cc2c(cc1NC(=O)[C@@H](C)Nc1ccccc1CO)oc1ccccc12.
What is the InChIKey of (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide?
The InChIKey is FSTIDSDNELCRPX-CQSZACIVSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-14(24-18-9-5-3-7-15(18)13-26)23(27)25-19-12-21-17(11-22(19)28-2)16-8-4-6-10-20(16)29-21/h3-12,14,24,26H,13H2,1-2H3,(H,25,27)/t14-/m1/s1.
What are the key properties of (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide?
(2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide has a molecular weight of 390.44 g/mol, XLogP of 4.53, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-(hydroxymethyl)anilino]-N-(2-methoxydibenzofuran-3-yl)propanamide is sourced from PubChem (CID 2421462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).