N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide

C20H26N2O4 — CID 51968449

IUPACN-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
SMILESCN(C)[C@@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)c1ccco1
InChIInChI=1S/C20H26N2O4/c1-22(2)18(19-6-4-12-25-19)13-21-20(23)15-7-9-16(10-8-15)26-14-17-5-3-11-24-17/h4,6-10,12,17-18H,3,5,11,13-14H2,1-2H3,(H,21,23)/t17-,18+/m1/s1
InChIKeyMGNJTBCHQMDJBI-MSOLQXFVSA-N
MW358.44 g/mol
LogP2.87
Rot. Bonds8

About N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide

N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide (PubChem CID 51968449) has the molecular formula C20H26N2O4 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide.

Molecular Properties

Compound NameN-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
PubChem CID51968449
Molecular FormulaC20H26N2O4
Molecular Weight358.44 g/mol
Exact Mass358.19
IUPAC NameN-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
SMILESCN(C)[C@@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)c1ccco1
InChIInChI=1S/C20H26N2O4/c1-22(2)18(19-6-4-12-25-19)13-21-20(23)15-7-9-16(10-8-15)26-14-17-5-3-11-24-17/h4,6-10,12,17-18H,3,5,11,13-14H2,1-2H3,(H,21,23)/t17-,18+/m1/s1
InChIKeyMGNJTBCHQMDJBI-MSOLQXFVSA-N
XLogP2.87
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide with MolForge

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Related Compounds

N-[(2R)-2-(dimethylamino)-2-phenylethyl]-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 32729367
N-[(2R)-2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 34962763
N-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 32629427
N-[furan-2-yl(phenyl)methyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 134029356
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(oxan-2-yl)acetamide
CID 110621230
N-[2-(dimethylamino)-2-phenylethyl]-3-(oxolan-2-ylmethoxy)benzamide
CID 43044138
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-iodobenzamide
CID 51145105
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-fluorobenzamide;hydrochloride
CID 52985207
N'-benzoyl-4-[[(2R)-oxolan-2-yl]methoxy]benzohydrazide
CID 2093036
N-[2-(cyclopropanecarbonylamino)ethyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 51153011
N-(2-amino-2-ethylbutyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 119641383
methyl 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzoate
CID 17222269

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The IUPAC name of N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide (CID 51968449) is N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide.
What is the SMILES notation for N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The canonical SMILES for N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide is CN(C)[C@@H](CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1)c1ccco1.
What is the InChIKey of N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The InChIKey is MGNJTBCHQMDJBI-MSOLQXFVSA-N. The full InChI is InChI=1S/C20H26N2O4/c1-22(2)18(19-6-4-12-25-19)13-21-20(23)15-7-9-16(10-8-15)26-14-17-5-3-11-24-17/h4,6-10,12,17-18H,3,5,11,13-14H2,1-2H3,(H,21,23)/t17-,18+/m1/s1.
What are the key properties of N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide has a molecular weight of 358.44 g/mol, XLogP of 2.87, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide is sourced from PubChem (CID 51968449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).