N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide

C12H18N2O4 — CID 55060862

IUPACN-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
SMILESCC(O)CN(C)C(=O)CN(C)C(=O)c1ccco1
InChIInChI=1S/C12H18N2O4/c1-9(15)7-13(2)11(16)8-14(3)12(17)10-5-4-6-18-10/h4-6,9,15H,7-8H2,1-3H3
InChIKeySLAVDBSJZIAVMY-UHFFFAOYSA-N
MW254.29 g/mol
LogP0.19
Rot. Bonds5

About N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide

N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide (PubChem CID 55060862) has the molecular formula C12H18N2O4 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
PubChem CID55060862
Molecular FormulaC12H18N2O4
Molecular Weight254.29 g/mol
Exact Mass254.13
IUPAC NameN-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
SMILESCC(O)CN(C)C(=O)CN(C)C(=O)c1ccco1
InChIInChI=1S/C12H18N2O4/c1-9(15)7-13(2)11(16)8-14(3)12(17)10-5-4-6-18-10/h4-6,9,15H,7-8H2,1-3H3
InChIKeySLAVDBSJZIAVMY-UHFFFAOYSA-N
XLogP0.19
TPSA73.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[furan-2-carbonyl(methyl)amino]acetate
CID 6943452
N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide
CID 115968439
N-[2-[(4-tert-butylphenyl)methyl-methylamino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 43047921
N-[2-(ethoxyamino)-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 47149757
methyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 43407344
tert-butyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 78991307
N-(2-amino-2-hydroxyiminoethyl)-N-methylfuran-2-carboxamide
CID 76928863
N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide
CID 15134402
3-[ethyl-[2-[furan-2-carbonyl(methyl)amino]acetyl]amino]propanoic acid
CID 61008405
N-[2-[2-hydroxyethyl(prop-2-enyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 115775719
propyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 91700657
N-butyl-N-methylfuran-2-carboxamide
CID 60670878

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The IUPAC name of N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide (CID 55060862) is N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide is CC(O)CN(C)C(=O)CN(C)C(=O)c1ccco1.
What is the InChIKey of N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
The InChIKey is SLAVDBSJZIAVMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4/c1-9(15)7-13(2)11(16)8-14(3)12(17)10-5-4-6-18-10/h4-6,9,15H,7-8H2,1-3H3.
What are the key properties of N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide?
N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide has a molecular weight of 254.29 g/mol, XLogP of 0.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 55060862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).