5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid

C17H24N2O5 — CID 90652941

IUPAC5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
SMILESO=C(O)c1ccc(CNC(=O)C2(N3CCOCC3)CCCCC2)o1
InChIInChI=1S/C17H24N2O5/c20-15(21)14-5-4-13(24-14)12-18-16(22)17(6-2-1-3-7-17)19-8-10-23-11-9-19/h4-5H,1-3,6-12H2,(H,18,22)(H,20,21)
InChIKeyLOVHSTZLGRWDGP-UHFFFAOYSA-N
MW336.39 g/mol
LogP1.63
Rot. Bonds5

About 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid

5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid (PubChem CID 90652941) has the molecular formula C17H24N2O5 and a molecular weight of 336.39 g/mol. Its IUPAC name is 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid.

Molecular Properties

Compound Name5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
PubChem CID90652941
Molecular FormulaC17H24N2O5
Molecular Weight336.39 g/mol
Exact Mass336.17
IUPAC Name5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
SMILESO=C(O)c1ccc(CNC(=O)C2(N3CCOCC3)CCCCC2)o1
InChIInChI=1S/C17H24N2O5/c20-15(21)14-5-4-13(24-14)12-18-16(22)17(6-2-1-3-7-17)19-8-10-23-11-9-19/h4-5H,1-3,6-12H2,(H,18,22)(H,20,21)
InChIKeyLOVHSTZLGRWDGP-UHFFFAOYSA-N
XLogP1.63
TPSA92.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid with MolForge

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Related Compounds

1-morpholin-4-yl-N-[(5-phenylfuran-2-yl)methyl]cyclohexane-1-carboxamide
CID 118766127
5-[[(1-methylcycloheptanecarbonyl)amino]methyl]furan-2-carboxylic acid
CID 120527275
1-morpholin-4-yl-N-[[4-(1,2,4-oxadiazol-3-yl)phenyl]methyl]cyclohexane-1-carboxamide
CID 118791034
5-[[(1-hydroxycyclohexyl)methylamino]methyl]furan-2-carboxylic acid
CID 65107448
1-morpholin-4-yl-N-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]cyclobutane-1-carboxamide
CID 136522349
5-[[[4-(hydroxymethyl)oxan-4-yl]amino]methyl]furan-2-carboxylic acid
CID 106297075
5-[[(1-thiophen-2-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
CID 119246078
N-(1-benzofuran-2-ylmethyl)-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 131897762
N-[(4-phenyloxan-4-yl)methyl]-1-pyrrolidin-1-ylcyclohexane-1-carboxamide
CID 131926281
N-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-1-morpholin-4-ylcyclohexane-1-carboxamide
CID 91765118
5-[[(2,2-dimethylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid
CID 107175730
5-[(adamantane-1-carbonylamino)methyl]furan-2-carboxylic acid
CID 119245737

Frequently Asked Questions

What is the IUPAC name of 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid?
The IUPAC name of 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid (CID 90652941) is 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid.
What is the SMILES notation for 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid?
The canonical SMILES for 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid is O=C(O)c1ccc(CNC(=O)C2(N3CCOCC3)CCCCC2)o1.
What is the InChIKey of 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid?
The InChIKey is LOVHSTZLGRWDGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O5/c20-15(21)14-5-4-13(24-14)12-18-16(22)17(6-2-1-3-7-17)19-8-10-23-11-9-19/h4-5H,1-3,6-12H2,(H,18,22)(H,20,21).
What are the key properties of 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid?
5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid has a molecular weight of 336.39 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1-morpholin-4-ylcyclohexanecarbonyl)amino]methyl]furan-2-carboxylic acid is sourced from PubChem (CID 90652941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).