N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide

C15H20N4O4 — CID 166208789

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide
SMILESCN(C)C(CNC(=O)c1cn(C)c(=O)n(C)c1=O)c1ccco1
InChIInChI=1S/C15H20N4O4/c1-17(2)11(12-6-5-7-23-12)8-16-13(20)10-9-18(3)15(22)19(4)14(10)21/h5-7,9,11H,8H2,1-4H3,(H,16,20)
InChIKeyRPBKOKJHVVGFFM-UHFFFAOYSA-N
MW320.35 g/mol
LogP-0.29
Rot. Bonds5

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide (PubChem CID 166208789) has the molecular formula C15H20N4O4 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide
PubChem CID166208789
Molecular FormulaC15H20N4O4
Molecular Weight320.35 g/mol
Exact Mass320.15
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide
SMILESCN(C)C(CNC(=O)c1cn(C)c(=O)n(C)c1=O)c1ccco1
InChIInChI=1S/C15H20N4O4/c1-17(2)11(12-6-5-7-23-12)8-16-13(20)10-9-18(3)15(22)19(4)14(10)21/h5-7,9,11H,8H2,1-4H3,(H,16,20)
InChIKeyRPBKOKJHVVGFFM-UHFFFAOYSA-N
XLogP-0.29
TPSA89.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide
CID 84555569
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 26818992
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylsulfanylbenzamide
CID 4878728
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2,3-dimethylbenzamide
CID 51162753
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 95977473
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-fluoro-3-methylbenzamide
CID 80710543
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide;hydrochloride
CID 20994951
2-bromo-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-methylbenzamide
CID 103852810
2-N,6-N-bis[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyridine-2,6-dicarboxamide
CID 46604974
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 94177772
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-iodobenzamide
CID 51145105
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-fluorobenzamide;hydrochloride
CID 52985207

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide (CID 166208789) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide is CN(C)C(CNC(=O)c1cn(C)c(=O)n(C)c1=O)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide?
The InChIKey is RPBKOKJHVVGFFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O4/c1-17(2)11(12-6-5-7-23-12)8-16-13(20)10-9-18(3)15(22)19(4)14(10)21/h5-7,9,11H,8H2,1-4H3,(H,16,20).
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide has a molecular weight of 320.35 g/mol, XLogP of -0.29, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide is sourced from PubChem (CID 166208789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).