N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide

C19H25N3O4 — CID 72864173

IUPACN-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide
SMILESCN(Cc1noc2c1CCCC2)C(=O)c1coc(CN2CCOCC2)c1
InChIInChI=1S/C19H25N3O4/c1-21(12-17-16-4-2-3-5-18(16)26-20-17)19(23)14-10-15(25-13-14)11-22-6-8-24-9-7-22/h10,13H,2-9,11-12H2,1H3
InChIKeyZGRKPAVOFZVMTR-UHFFFAOYSA-N
MW359.43 g/mol
LogP2.25
Rot. Bonds5

About N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide

N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide (PubChem CID 72864173) has the molecular formula C19H25N3O4 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide
PubChem CID72864173
Molecular FormulaC19H25N3O4
Molecular Weight359.43 g/mol
Exact Mass359.18
IUPAC NameN-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide
SMILESCN(Cc1noc2c1CCCC2)C(=O)c1coc(CN2CCOCC2)c1
InChIInChI=1S/C19H25N3O4/c1-21(12-17-16-4-2-3-5-18(16)26-20-17)19(23)14-10-15(25-13-14)11-22-6-8-24-9-7-22/h10,13H,2-9,11-12H2,1H3
InChIKeyZGRKPAVOFZVMTR-UHFFFAOYSA-N
XLogP2.25
TPSA71.95 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazol-3-ylmethyl)-N-methyl-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 72878273
N-(isoquinolin-5-ylmethyl)-N-methyl-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 72862091
N-methyl-N-[(4-methylphenyl)methyl]-5-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 56741639
N-methyl-5-(morpholin-4-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]-1,2-oxazole-3-carboxamide
CID 95216881
(2R)-N,2-dimethyl-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 126434473
N-methyl-5-(morpholin-4-ylmethyl)-N-[1-(1,3,5-trimethylpyrazol-4-yl)ethyl]furan-3-carboxamide
CID 74241118
N-[2-(dimethylsulfamoyl)ethyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 74245817
N-methyl-7-propan-2-yl-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxamide
CID 72928173
2-(4-ethyl-2,3-dioxopiperazin-1-yl)-N-methyl-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)acetamide
CID 72863820
N-methyl-2-[(3S)-3-phenylpiperidin-1-yl]-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)acetamide
CID 97283111
N-[2-[(3-methyl-2-pyridinyl)amino]ethyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 72885838
N-methyl-5-(morpholin-4-ylmethyl)-N-(2-pyridin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 56758608

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide?
The IUPAC name of N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide (CID 72864173) is N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide.
What is the SMILES notation for N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide?
The canonical SMILES for N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide is CN(Cc1noc2c1CCCC2)C(=O)c1coc(CN2CCOCC2)c1.
What is the InChIKey of N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide?
The InChIKey is ZGRKPAVOFZVMTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O4/c1-21(12-17-16-4-2-3-5-18(16)26-20-17)19(23)14-10-15(25-13-14)11-22-6-8-24-9-7-22/h10,13H,2-9,11-12H2,1H3.
What are the key properties of N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide?
N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 2.25, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(morpholin-4-ylmethyl)-N-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)furan-3-carboxamide is sourced from PubChem (CID 72864173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).