7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide

C13H17N5O3 — CID 23476517

IUPAC7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide
SMILESCCCc1c(C(N)=O)c(N)nc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C13H17N5O3/c1-4-5-6-7(10(15)19)9(14)16-11-8(6)12(20)18(3)13(21)17(11)2/h4-5H2,1-3H3,(H2,14,16)(H2,15,19)
InChIKeyVUPLVMDYLGFIHY-UHFFFAOYSA-N
MW291.31 g/mol
LogP-0.73
Rot. Bonds3

About 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide

7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide (PubChem CID 23476517) has the molecular formula C13H17N5O3 and a molecular weight of 291.31 g/mol. Its IUPAC name is 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide
PubChem CID23476517
Molecular FormulaC13H17N5O3
Molecular Weight291.31 g/mol
Exact Mass291.13
IUPAC Name7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide
SMILESCCCc1c(C(N)=O)c(N)nc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C13H17N5O3/c1-4-5-6-7(10(15)19)9(14)16-11-8(6)12(20)18(3)13(21)17(11)2/h4-5H2,1-3H3,(H2,14,16)(H2,15,19)
InChIKeyVUPLVMDYLGFIHY-UHFFFAOYSA-N
XLogP-0.73
TPSA126.00 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

7-amino-N-benzyl-1,3,5-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 23476483
7-amino-N-[(4-chlorophenyl)methyl]-1,3,5-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 23476487
7-amino-N-(benzenesulfonyl)-1,3,5-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 23476488
1,3-dimethyl-5-phenacylsulfanyl-7-propylpyrimido[4,5-d]pyrimidine-2,4-dione
CID 7110352
5-amino-2,4,7,9-tetramethylpyrimido[4,5-h][1,6]naphthyridine-8,10-dione
CID 46872676
4-amino-1-methyl-2-methylsulfanyl-6-oxopyrimidine-5-carboxamide
CID 20850092
7-amino-5-(3,4-dimethoxyphenyl)-N-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 23476622
7-amino-5-tert-butyl-1,3-dimethyl-2,4-dioxo-N-pyridin-3-ylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 23476572
2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide
CID 567556
7-amino-5-chloro-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 10538050
N-cyclopentyl-2-(1,3-dimethyl-2,4-dioxo-7-propylpyrimido[4,5-d]pyrimidin-5-yl)sulfanylacetamide
CID 7158922
7-(2-aminoethyl)-1,3-dimethyl-8-propylpurine-2,6-dione
CID 51058603

Frequently Asked Questions

What is the IUPAC name of 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide (CID 23476517) is 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide is CCCc1c(C(N)=O)c(N)nc2c1c(=O)n(C)c(=O)n2C.
What is the InChIKey of 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is VUPLVMDYLGFIHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O3/c1-4-5-6-7(10(15)19)9(14)16-11-8(6)12(20)18(3)13(21)17(11)2/h4-5H2,1-3H3,(H2,14,16)(H2,15,19).
What are the key properties of 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide?
7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 291.31 g/mol, XLogP of -0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-1,3-dimethyl-2,4-dioxo-5-propylpyrido[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 23476517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).