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

C19H25N5O3 — CID 119375755

IUPAC5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)[nH]c(=O)c2c(C(=O)N3CCC(N)CC3)cc(C3CC3)nc21
InChIInChI=1S/C19H25N5O3/c1-2-7-24-16-15(17(25)22-19(24)27)13(10-14(21-16)11-3-4-11)18(26)23-8-5-12(20)6-9-23/h10-12H,2-9,20H2,1H3,(H,22,25,27)
InChIKeyQJLKJVAZZGTGAO-UHFFFAOYSA-N
MW371.44 g/mol
LogP0.94
Rot. Bonds4

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

5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 119375755) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID119375755
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC Name5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)[nH]c(=O)c2c(C(=O)N3CCC(N)CC3)cc(C3CC3)nc21
InChIInChI=1S/C19H25N5O3/c1-2-7-24-16-15(17(25)22-19(24)27)13(10-14(21-16)11-3-4-11)18(26)23-8-5-12(20)6-9-23/h10-12H,2-9,20H2,1H3,(H,22,25,27)
InChIKeyQJLKJVAZZGTGAO-UHFFFAOYSA-N
XLogP0.94
TPSA114.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione (CID 119375755) is 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione is CCCn1c(=O)[nH]c(=O)c2c(C(=O)N3CCC(N)CC3)cc(C3CC3)nc21.
What is the InChIKey of 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is QJLKJVAZZGTGAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-2-7-24-16-15(17(25)22-19(24)27)13(10-14(21-16)11-3-4-11)18(26)23-8-5-12(20)6-9-23/h10-12H,2-9,20H2,1H3,(H,22,25,27).
What are the key properties of 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione?
5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 371.44 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminopiperidine-1-carbonyl)-7-cyclopropyl-1-propylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 119375755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).