5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione

C24H25ClN4O4 — CID 55948407

IUPAC5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)[nH]c(=O)c2c(C(=O)N3CCOC(c4ccc(Cl)cc4)C3)cc(C3CC3)nc21
InChIInChI=1S/C24H25ClN4O4/c1-2-9-29-21-20(22(30)27-24(29)32)17(12-18(26-21)14-3-4-14)23(31)28-10-11-33-19(13-28)15-5-7-16(25)8-6-15/h5-8,12,14,19H,2-4,9-11,13H2,1H3,(H,27,30,32)
InChIKeyRVCXTVDBTYOUFR-UHFFFAOYSA-N
MW468.94 g/mol
LogP3.24
Rot. Bonds5

About 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione

5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 55948407) has the molecular formula C24H25ClN4O4 and a molecular weight of 468.94 g/mol. Its IUPAC name is 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID55948407
Molecular FormulaC24H25ClN4O4
Molecular Weight468.94 g/mol
Exact Mass468.16
IUPAC Name5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)[nH]c(=O)c2c(C(=O)N3CCOC(c4ccc(Cl)cc4)C3)cc(C3CC3)nc21
InChIInChI=1S/C24H25ClN4O4/c1-2-9-29-21-20(22(30)27-24(29)32)17(12-18(26-21)14-3-4-14)23(31)28-10-11-33-19(13-28)15-5-7-16(25)8-6-15/h5-8,12,14,19H,2-4,9-11,13H2,1H3,(H,27,30,32)
InChIKeyRVCXTVDBTYOUFR-UHFFFAOYSA-N
XLogP3.24
TPSA97.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.94
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione with MolForge

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Related Compounds

5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 119375755
5-(3-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione;hydrochloride
CID 119380475
7-cyclopropyl-5-[3-(methylaminomethyl)piperidine-1-carbonyl]-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 119397751
5-(2-methylmorpholine-4-carbonyl)-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 134054087
5-(6-chloro-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 154861379
7-cyclopropyl-5-[4-[(3-fluorophenyl)methyl]piperidine-1-carbonyl]-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
CID 112843664
N-[(5-chloro-2-methoxyphenyl)methyl]-7-cyclopropyl-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 78887243
7-cyclopropyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 39266376
N-(2-aminophenyl)-7-cyclopropyl-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide;hydrochloride
CID 119422524
N-(2-amino-2-methylpropyl)-7-cyclopropyl-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 119629261
N-(2-amino-2-methylpropyl)-7-cyclopropyl-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide;hydrochloride
CID 119629260
N-(4-anilinophenyl)-7-cyclopropyl-2,4-dioxo-1-propylpyrido[2,3-d]pyrimidine-5-carboxamide
CID 37126644

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione (CID 55948407) is 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione is CCCn1c(=O)[nH]c(=O)c2c(C(=O)N3CCOC(c4ccc(Cl)cc4)C3)cc(C3CC3)nc21.
What is the InChIKey of 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is RVCXTVDBTYOUFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25ClN4O4/c1-2-9-29-21-20(22(30)27-24(29)32)17(12-18(26-21)14-3-4-14)23(31)28-10-11-33-19(13-28)15-5-7-16(25)8-6-15/h5-8,12,14,19H,2-4,9-11,13H2,1H3,(H,27,30,32).
What are the key properties of 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 468.94 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-chlorophenyl)morpholine-4-carbonyl]-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 55948407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).