1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide

C16H22N4O3 — CID 36715420

IUPAC1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc2c(c1)c(=O)[nH]c(=O)n2CC
InChIInChI=1S/C16H22N4O3/c1-4-7-19(8-5-2)15(22)11-9-12-13(17-10-11)20(6-3)16(23)18-14(12)21/h9-10H,4-8H2,1-3H3,(H,18,21,23)
InChIKeyVHJZQUJKNCGULY-UHFFFAOYSA-N
MW318.38 g/mol
LogP1.37
Rot. Bonds6

About 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide

1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide (PubChem CID 36715420) has the molecular formula C16H22N4O3 and a molecular weight of 318.38 g/mol. Its IUPAC name is 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide
PubChem CID36715420
Molecular FormulaC16H22N4O3
Molecular Weight318.38 g/mol
Exact Mass318.17
IUPAC Name1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc2c(c1)c(=O)[nH]c(=O)n2CC
InChIInChI=1S/C16H22N4O3/c1-4-7-19(8-5-2)15(22)11-9-12-13(17-10-11)20(6-3)16(23)18-14(12)21/h9-10H,4-8H2,1-3H3,(H,18,21,23)
InChIKeyVHJZQUJKNCGULY-UHFFFAOYSA-N
XLogP1.37
TPSA88.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-2,4-dioxo-N-(1-phenylbutyl)pyrido[2,3-d]pyrimidine-6-carboxamide
CID 42943182
N-(2-ethoxyethyl)-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 87046001
N-(2-methylbutan-2-yl)-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 46554711
6-(morpholine-4-carbonyl)-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 36708442
N-[3-(2-methoxyethoxy)propyl]-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 55678363
N-methyl-2,4-dioxo-1-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]pyrido[2,3-d]pyrimidine-6-carboxamide
CID 78844910
2,4-dioxo-1-propyl-N-[2-[4-(trifluoromethyl)phenyl]ethyl]pyrido[2,3-d]pyrimidine-6-carboxamide
CID 37137967
(5-chloro-1-methylimidazol-2-yl)methyl 2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxylate
CID 87044438
5,6-dichloro-1-ethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 114759819
2,4-dioxo-N-[2-(1-phenylpyrazol-4-yl)ethyl]-1-propylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 55555466
N-(1-cyclopropylpiperidin-4-yl)-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 46553241
N-(3-chloro-2-methylphenyl)-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 36709707

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide (CID 36715420) is 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide is CCCN(CCC)C(=O)c1cnc2c(c1)c(=O)[nH]c(=O)n2CC.
What is the InChIKey of 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is VHJZQUJKNCGULY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O3/c1-4-7-19(8-5-2)15(22)11-9-12-13(17-10-11)20(6-3)16(23)18-14(12)21/h9-10H,4-8H2,1-3H3,(H,18,21,23).
What are the key properties of 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide?
1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,4-dioxo-N,N-dipropylpyrido[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 36715420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).