5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide

C15H19N5O3 — CID 119537574

IUPAC5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NCCC2CCNC2)nc2[nH]c(=O)[nH]c(=O)c12
InChIInChI=1S/C15H19N5O3/c1-8-6-10(13(21)17-5-3-9-2-4-16-7-9)18-12-11(8)14(22)20-15(23)19-12/h6,9,16H,2-5,7H2,1H3,(H,17,21)(H2,18,19,20,22,23)
InChIKeyPPQWZGCEVGNUQP-UHFFFAOYSA-N
MW317.35 g/mol
LogP-0.35
Rot. Bonds4

About 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide

5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide (PubChem CID 119537574) has the molecular formula C15H19N5O3 and a molecular weight of 317.35 g/mol. Its IUPAC name is 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
PubChem CID119537574
Molecular FormulaC15H19N5O3
Molecular Weight317.35 g/mol
Exact Mass317.15
IUPAC Name5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NCCC2CCNC2)nc2[nH]c(=O)[nH]c(=O)c12
InChIInChI=1S/C15H19N5O3/c1-8-6-10(13(21)17-5-3-9-2-4-16-7-9)18-12-11(8)14(22)20-15(23)19-12/h6,9,16H,2-5,7H2,1H3,(H,17,21)(H2,18,19,20,22,23)
InChIKeyPPQWZGCEVGNUQP-UHFFFAOYSA-N
XLogP-0.35
TPSA119.74 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 5-0.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide with MolForge

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Related Compounds

2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-6-carboxamide;dihydrochloride
CID 119537449
5-methyl-N-(2-pyrrolidin-3-ylethyl)-1,2-oxazole-3-carboxamide
CID 63622674
5-methyl-2,4-dioxo-N-propyl-N-pyrrolidin-3-yl-1H-pyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride
CID 119532741
5-methyl-2,4-dioxo-N-piperidin-4-yl-N-propyl-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 119825932
5-methyl-N-(2-methylpiperidin-4-yl)-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 120597862
3,4-dimethyl-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119537772
2,4-dioxo-N-(2-piperidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-6-carboxamide;dihydrochloride
CID 119558800
3-fluoro-4-methyl-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 63622867
N-[1-(aminomethyl)cyclopentyl]-5-methyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-7-carboxamide
CID 119568015
N-(2-pyrrolidin-3-ylethyl)-1,2,5-thiadiazole-3-carboxamide
CID 63630234
2,6-dimethyl-N-(2-pyrrolidin-3-ylethyl)pyridine-3-carboxamide;dihydrochloride
CID 119537084
5-bromo-6-oxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyridine-3-carboxamide;hydrochloride
CID 119537569

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
The IUPAC name of 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide (CID 119537574) is 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide.
What is the SMILES notation for 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
The canonical SMILES for 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide is Cc1cc(C(=O)NCCC2CCNC2)nc2[nH]c(=O)[nH]c(=O)c12.
What is the InChIKey of 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
The InChIKey is PPQWZGCEVGNUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3/c1-8-6-10(13(21)17-5-3-9-2-4-16-7-9)18-12-11(8)14(22)20-15(23)19-12/h6,9,16H,2-5,7H2,1H3,(H,17,21)(H2,18,19,20,22,23).
What are the key properties of 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide?
5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide has a molecular weight of 317.35 g/mol, XLogP of -0.35, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,4-dioxo-N-(2-pyrrolidin-3-ylethyl)-1H-pyrido[2,3-d]pyrimidine-7-carboxamide is sourced from PubChem (CID 119537574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).