5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine

C18H21N7O2 — CID 53377951

IUPAC5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
SMILESCC(C)Oc1ccc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2n1
InChIInChI=1S/C18H21N7O2/c1-11(2)27-14-4-3-13-15(23-14)17(25-5-7-26-8-6-25)24-16(22-13)12-9-20-18(19)21-10-12/h3-4,9-11H,5-8H2,1-2H3,(H2,19,20,21)
InChIKeyVYMKSNWRUMADJQ-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.69
Rot. Bonds4

About 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine

5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine (PubChem CID 53377951) has the molecular formula C18H21N7O2 and a molecular weight of 367.41 g/mol. Its IUPAC name is 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
PubChem CID53377951
Molecular FormulaC18H21N7O2
Molecular Weight367.41 g/mol
Exact Mass367.18
IUPAC Name5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
SMILESCC(C)Oc1ccc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2n1
InChIInChI=1S/C18H21N7O2/c1-11(2)27-14-4-3-13-15(23-14)17(25-5-7-26-8-6-25)24-16(22-13)12-9-20-18(19)21-10-12/h3-4,9-11H,5-8H2,1-2H3,(H2,19,20,21)
InChIKeyVYMKSNWRUMADJQ-UHFFFAOYSA-N
XLogP1.69
TPSA112.17 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 58405017
5-(9-ethyl-6-morpholin-4-ylpurin-2-yl)pyrimidin-2-amine
CID 143903048
4-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-7-yl]-N-methylbenzamide
CID 73057746
5-(8-ethyl-9-methyl-6-morpholin-4-ylpurin-2-yl)pyrimidin-2-amine
CID 127049341
5-(2-aminopyrimidin-5-yl)-N-(4-methylsulfonylphenyl)-7-morpholin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
CID 25254303
N-[3-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-7-yl]phenyl]-2-fluoropropanamide
CID 73053951
1-[3-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-7-yl]phenyl]-3,3-dimethylbutan-2-one
CID 161430959
5-(5-methyl-4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 59829304
5-[4-morpholin-4-yl-6-(1-piperazin-1-ylethyl)thieno[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
CID 143690177
5-[4-morpholin-4-yl-6-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
CID 59829333
5-(2-methyl-7-morpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-yl)pyrimidin-2-amine
CID 143782763
5-(6-methyl-4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 59829563

Frequently Asked Questions

What is the IUPAC name of 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
The IUPAC name of 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine (CID 53377951) is 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
The canonical SMILES for 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine is CC(C)Oc1ccc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2n1.
What is the InChIKey of 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
The InChIKey is VYMKSNWRUMADJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7O2/c1-11(2)27-14-4-3-13-15(23-14)17(25-5-7-26-8-6-25)24-16(22-13)12-9-20-18(19)21-10-12/h3-4,9-11H,5-8H2,1-2H3,(H2,19,20,21).
What are the key properties of 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine has a molecular weight of 367.41 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 53377951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).