N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide

C14H20N2O5 — CID 107302243

IUPACN-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide
SMILESCC1OCCC1(O)CNC(=O)CN(C)C(=O)c1ccco1
InChIInChI=1S/C14H20N2O5/c1-10-14(19,5-7-20-10)9-15-12(17)8-16(2)13(18)11-4-3-6-21-11/h3-4,6,10,19H,5,7-9H2,1-2H3,(H,15,17)
InChIKeyJCDPGDTVEQFEFP-UHFFFAOYSA-N
MW296.32 g/mol
LogP0.01
Rot. Bonds5

About N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide

N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide (PubChem CID 107302243) has the molecular formula C14H20N2O5 and a molecular weight of 296.32 g/mol. Its IUPAC name is N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide
PubChem CID107302243
Molecular FormulaC14H20N2O5
Molecular Weight296.32 g/mol
Exact Mass296.14
IUPAC NameN-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide
SMILESCC1OCCC1(O)CNC(=O)CN(C)C(=O)c1ccco1
InChIInChI=1S/C14H20N2O5/c1-10-14(19,5-7-20-10)9-15-12(17)8-16(2)13(18)11-4-3-6-21-11/h3-4,6,10,19H,5,7-9H2,1-2H3,(H,15,17)
InChIKeyJCDPGDTVEQFEFP-UHFFFAOYSA-N
XLogP0.01
TPSA92.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]propanamide
CID 106100304
3-[[2-[furan-2-carbonyl(methyl)amino]acetyl]amino]propanoic acid
CID 43170664
N-[2-[[(2R)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 93041382
3-(4-aminophenyl)-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]propanamide
CID 106099130
4-[[2-[furan-2-carbonyl(methyl)amino]acetyl]amino]oxolane-3-carboxylic acid
CID 66223325
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-2-[(3-methylphenyl)methylsulfanyl]acetamide
CID 107301824
N-[2-[[(1S,2S)-2-hydroxycyclohexyl]amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 104957500
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-2-pyridin-2-ylacetamide
CID 106102914
N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide
CID 115968439
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]acetamide
CID 107302191
N-[2-(ethoxyamino)-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 47149757
methyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 43407344

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The IUPAC name of N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide (CID 107302243) is N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide is CC1OCCC1(O)CNC(=O)CN(C)C(=O)c1ccco1.
What is the InChIKey of N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The InChIKey is JCDPGDTVEQFEFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5/c1-10-14(19,5-7-20-10)9-15-12(17)8-16(2)13(18)11-4-3-6-21-11/h3-4,6,10,19H,5,7-9H2,1-2H3,(H,15,17).
What are the key properties of N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide has a molecular weight of 296.32 g/mol, XLogP of 0.01, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-hydroxy-2-methyloxolan-3-yl)methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 107302243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).