1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide

C17H27N5O4 — CID 42926320

IUPAC1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCCCn1c(N)c(C(=O)CN2CCCC2C(=O)N(C)C)c(=O)n(C)c1=O
InChIInChI=1S/C17H27N5O4/c1-5-8-22-14(18)13(16(25)20(4)17(22)26)12(23)10-21-9-6-7-11(21)15(24)19(2)3/h11H,5-10,18H2,1-4H3
InChIKeyTZGNTCYDIUPZJC-UHFFFAOYSA-N
MW365.43 g/mol
LogP-0.73
Rot. Bonds6

About 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide

1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide (PubChem CID 42926320) has the molecular formula C17H27N5O4 and a molecular weight of 365.43 g/mol. Its IUPAC name is 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide
PubChem CID42926320
Molecular FormulaC17H27N5O4
Molecular Weight365.43 g/mol
Exact Mass365.21
IUPAC Name1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCCCn1c(N)c(C(=O)CN2CCCC2C(=O)N(C)C)c(=O)n(C)c1=O
InChIInChI=1S/C17H27N5O4/c1-5-8-22-14(18)13(16(25)20(4)17(22)26)12(23)10-21-9-6-7-11(21)15(24)19(2)3/h11H,5-10,18H2,1-4H3
InChIKeyTZGNTCYDIUPZJC-UHFFFAOYSA-N
XLogP-0.73
TPSA110.64 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide with MolForge

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Related Compounds

(2S)-1-[2-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide
CID 34929117
6-amino-3-methyl-1-propyl-5-(2-pyrrolidin-1-ylacetyl)pyrimidine-2,4-dione
CID 8901624
5-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)acetyl]-6-amino-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione
CID 112796880
5-[2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]acetyl]-6-amino-1-propylpyrimidine-2,4-dione
CID 11931412
2-[[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 9433261
N,N-dimethyl-1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]pyrrolidine-2-carboxamide
CID 86913220
[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium
CID 9332579
6-amino-3-methyl-5-[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]acetyl]-1-propylpyrimidine-2,4-dione
CID 9102366
[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl] benzoate
CID 7868471
6-amino-5-[2-[(2,4-dimethylphenyl)methyl-methylamino]acetyl]-3-methyl-1-propylpyrimidine-2,4-dione
CID 9045728
6-amino-5-[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-3-methyl-1-propylpyrimidine-2,4-dione
CID 16524252
N,N-dimethyl-1-[2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethyl]pyrrolidine-2-carboxamide
CID 134031706

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide (CID 42926320) is 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide is CCCn1c(N)c(C(=O)CN2CCCC2C(=O)N(C)C)c(=O)n(C)c1=O.
What is the InChIKey of 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide?
The InChIKey is TZGNTCYDIUPZJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O4/c1-5-8-22-14(18)13(16(25)20(4)17(22)26)12(23)10-21-9-6-7-11(21)15(24)19(2)3/h11H,5-10,18H2,1-4H3.
What are the key properties of 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide?
1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide has a molecular weight of 365.43 g/mol, XLogP of -0.73, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-N,N-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 42926320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).