N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide

C12H20N4O3 — CID 62636981

IUPACN-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide
SMILESCNC(C)C(=O)N(C)Cc1cn(C)c(=O)n(C)c1=O
InChIInChI=1S/C12H20N4O3/c1-8(13-2)10(17)14(3)6-9-7-15(4)12(19)16(5)11(9)18/h7-8,13H,6H2,1-5H3
InChIKeyNORVXQNFBWFABJ-UHFFFAOYSA-N
MW268.32 g/mol
LogP-1.35
Rot. Bonds4

About N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide

N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide (PubChem CID 62636981) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide
PubChem CID62636981
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC NameN-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide
SMILESCNC(C)C(=O)N(C)Cc1cn(C)c(=O)n(C)c1=O
InChIInChI=1S/C12H20N4O3/c1-8(13-2)10(17)14(3)6-9-7-15(4)12(19)16(5)11(9)18/h7-8,13H,6H2,1-5H3
InChIKeyNORVXQNFBWFABJ-UHFFFAOYSA-N
XLogP-1.35
TPSA76.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-1.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methylbutanediamide
CID 60963488
N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methylpropanamide
CID 64590695
N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-4-(methylamino)butanamide
CID 60963240
5-chloro-N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methylpentanamide
CID 60948566
methyl 2-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methylamino]propanoate
CID 60780540
2-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methylamino]acetic acid
CID 43135043
5-[[(1-hydroxy-4-methylpentan-3-yl)amino]methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 103700931
5-[[[(2R)-1-hydroxybutan-2-yl]amino]methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 28724674
N-[2-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methylamino]ethyl]acetamide
CID 28710634
1,3-dimethyl-5-[(N-methyl-3-methylsulfanylanilino)methyl]pyrimidine-2,4-dione
CID 99822152
5-[(4-methoxybutan-2-ylamino)methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 62733720
methyl (3R)-3-(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)butanoate
CID 7053167

Frequently Asked Questions

What is the IUPAC name of N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide?
The IUPAC name of N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide (CID 62636981) is N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide.
What is the SMILES notation for N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide?
The canonical SMILES for N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide is CNC(C)C(=O)N(C)Cc1cn(C)c(=O)n(C)c1=O.
What is the InChIKey of N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide?
The InChIKey is NORVXQNFBWFABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-8(13-2)10(17)14(3)6-9-7-15(4)12(19)16(5)11(9)18/h7-8,13H,6H2,1-5H3.
What are the key properties of N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide?
N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide has a molecular weight of 268.32 g/mol, XLogP of -1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl]-N-methyl-2-(methylamino)propanamide is sourced from PubChem (CID 62636981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).