2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide

C20H25N3O4 — CID 26551359

IUPAC2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESC[C@H]1CN(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)C[C@H](C)O1
InChIInChI=1S/C20H25N3O4/c1-14-11-23(12-15(2)27-14)13-19(24)22-18-8-4-3-7-17(18)20(25)21-10-16-6-5-9-26-16/h3-9,14-15H,10-13H2,1-2H3,(H,21,25)(H,22,24)/t14-,15-/m0/s1
InChIKeyTYGBJPRPPULCMB-GJZGRUSLSA-N
MW371.44 g/mol
LogP2.26
Rot. Bonds6

About 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide

2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide (PubChem CID 26551359) has the molecular formula C20H25N3O4 and a molecular weight of 371.44 g/mol. Its IUPAC name is 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
PubChem CID26551359
Molecular FormulaC20H25N3O4
Molecular Weight371.44 g/mol
Exact Mass371.18
IUPAC Name2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESC[C@H]1CN(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)C[C@H](C)O1
InChIInChI=1S/C20H25N3O4/c1-14-11-23(12-15(2)27-14)13-19(24)22-18-8-4-3-7-17(18)20(25)21-10-16-6-5-9-26-16/h3-9,14-15H,10-13H2,1-2H3,(H,21,25)(H,22,24)/t14-,15-/m0/s1
InChIKeyTYGBJPRPPULCMB-GJZGRUSLSA-N
XLogP2.26
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide with MolForge

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Related Compounds

2-[[2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 24507507
ethyl 1-[2-[2-(furan-2-ylmethylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxylate
CID 8773092
2-[(2-bromoacetyl)amino]-N-(furan-2-ylmethyl)benzamide
CID 112547104
N,N'-bis[2-(furan-2-ylmethylcarbamoyl)phenyl]hexanediamide
CID 4938791
N-(furan-2-ylmethyl)-2-[[2-[[2-(methylamino)-2-oxoethyl]amino]acetyl]amino]benzamide
CID 8772778
2-[[2-(2,6-dimethylmorpholin-4-yl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 51170473
N-(furan-2-ylmethyl)-2-[[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]benzamide
CID 34651174
2-(3-cyclopentylpropanoylamino)-N-(furan-2-ylmethyl)benzamide
CID 16576953
N-(furan-2-ylmethyl)-2-(heptanoylamino)benzamide
CID 36859009
2-[[2-[(2,3-dimethylcyclohexyl)amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 112796590
6-[[2-(furan-2-ylmethylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 4592767
2-[[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 8684008

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide (CID 26551359) is 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide is C[C@H]1CN(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)C[C@H](C)O1.
What is the InChIKey of 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is TYGBJPRPPULCMB-GJZGRUSLSA-N. The full InChI is InChI=1S/C20H25N3O4/c1-14-11-23(12-15(2)27-14)13-19(24)22-18-8-4-3-7-17(18)20(25)21-10-16-6-5-9-26-16/h3-9,14-15H,10-13H2,1-2H3,(H,21,25)(H,22,24)/t14-,15-/m0/s1.
What are the key properties of 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 371.44 g/mol, XLogP of 2.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 26551359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).