7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine

C24H31N7O — CID 11102108

IUPAC7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCCCC1CCN(c2cc(-c3ccc(N4CCOCC4)nc3)nc3ncnc(N)c23)CC1
InChIInChI=1S/C24H31N7O/c1-2-3-17-6-8-30(9-7-17)20-14-19(29-24-22(20)23(25)27-16-28-24)18-4-5-21(26-15-18)31-10-12-32-13-11-31/h4-5,14-17H,2-3,6-13H2,1H3,(H2,25,27,28,29)
InChIKeyUYEAFJRGGZADFG-UHFFFAOYSA-N
MW433.56 g/mol
LogP3.52
Rot. Bonds5

About 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine

7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 11102108) has the molecular formula C24H31N7O and a molecular weight of 433.56 g/mol. Its IUPAC name is 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine
PubChem CID11102108
Molecular FormulaC24H31N7O
Molecular Weight433.56 g/mol
Exact Mass433.26
IUPAC Name7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine
SMILESCCCC1CCN(c2cc(-c3ccc(N4CCOCC4)nc3)nc3ncnc(N)c23)CC1
InChIInChI=1S/C24H31N7O/c1-2-3-17-6-8-30(9-7-17)20-14-19(29-24-22(20)23(25)27-16-28-24)18-4-5-21(26-15-18)31-10-12-32-13-11-31/h4-5,14-17H,2-3,6-13H2,1H3,(H2,25,27,28,29)
InChIKeyUYEAFJRGGZADFG-UHFFFAOYSA-N
XLogP3.52
TPSA93.29 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.56
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine (CID 11102108) is 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine is CCCC1CCN(c2cc(-c3ccc(N4CCOCC4)nc3)nc3ncnc(N)c23)CC1.
What is the InChIKey of 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is UYEAFJRGGZADFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N7O/c1-2-3-17-6-8-30(9-7-17)20-14-19(29-24-22(20)23(25)27-16-28-24)18-4-5-21(26-15-18)31-10-12-32-13-11-31/h4-5,14-17H,2-3,6-13H2,1H3,(H2,25,27,28,29).
What are the key properties of 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine?
7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 433.56 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-morpholin-4-yl-3-pyridinyl)-5-(4-propylpiperidin-1-yl)pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 11102108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).