N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide

C12H18N2O3 — CID 47125598

IUPACN-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide
SMILESCC1CN(C(=O)NCc2ccco2)CC(C)O1
InChIInChI=1S/C12H18N2O3/c1-9-7-14(8-10(2)17-9)12(15)13-6-11-4-3-5-16-11/h3-5,9-10H,6-8H2,1-2H3,(H,13,15)
InChIKeyCQYSLVRFVBTDLE-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.60
Rot. Bonds2

About N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide

N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide (PubChem CID 47125598) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide
PubChem CID47125598
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide
SMILESCC1CN(C(=O)NCc2ccco2)CC(C)O1
InChIInChI=1S/C12H18N2O3/c1-9-7-14(8-10(2)17-9)12(15)13-6-11-4-3-5-16-11/h3-5,9-10H,6-8H2,1-2H3,(H,13,15)
InChIKeyCQYSLVRFVBTDLE-UHFFFAOYSA-N
XLogP1.60
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-dimethylmorpholin-4-yl)-N-(furan-2-ylmethyl)-2-oxoacetamide
CID 108503950
N-(furan-2-ylmethyl)-2-methyl-6-thiophen-3-ylmorpholine-4-carboxamide
CID 71919520
4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]-N-(furan-2-ylmethyl)benzenesulfonamide
CID 2531360
N-[(4-chlorophenyl)methyl]-2,6-dimethylmorpholine-4-carboxamide
CID 108899201
2,6-dimethyl-N-[(3-methylphenyl)methyl]morpholine-4-carboxamide
CID 108898086
N-[[2-(methoxymethyl)phenyl]methyl]-2,6-dimethylmorpholine-4-carboxamide
CID 42958139
2-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 26551359
2,6-dimethyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]morpholine-4-carboxamide
CID 51291268
tert-butyl 4-(furan-2-ylmethylcarbamoyl)piperazine-1-carboxylate
CID 127575362
4-[(3R)-1-(furan-2-ylmethylcarbamoyl)piperidin-3-yl]benzoic acid
CID 97203993
4-(2-chloro-4,6-dimethylphenyl)-N-(furan-2-ylmethyl)piperazine-1-carboxamide
CID 113106498
N-(furan-2-ylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 16645751

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide (CID 47125598) is N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide is CC1CN(C(=O)NCc2ccco2)CC(C)O1.
What is the InChIKey of N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide?
The InChIKey is CQYSLVRFVBTDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-9-7-14(8-10(2)17-9)12(15)13-6-11-4-3-5-16-11/h3-5,9-10H,6-8H2,1-2H3,(H,13,15).
What are the key properties of N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide?
N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2,6-dimethylmorpholine-4-carboxamide is sourced from PubChem (CID 47125598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).