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

C18H19N7O — CID 58405017

IUPAC5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
SMILESNc1ncc(-c2nc(N3CCOCC3)c3nc(C4CC4)ccc3n2)cn1
InChIInChI=1S/C18H19N7O/c19-18-20-9-12(10-21-18)16-23-14-4-3-13(11-1-2-11)22-15(14)17(24-16)25-5-7-26-8-6-25/h3-4,9-11H,1-2,5-8H2,(H2,19,20,21)
InChIKeySHWOWHBLMBPBSX-UHFFFAOYSA-N
MW349.40 g/mol
LogP1.78
Rot. Bonds3

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

5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine (PubChem CID 58405017) has the molecular formula C18H19N7O and a molecular weight of 349.40 g/mol. Its IUPAC name is 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
PubChem CID58405017
Molecular FormulaC18H19N7O
Molecular Weight349.40 g/mol
Exact Mass349.17
IUPAC Name5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
SMILESNc1ncc(-c2nc(N3CCOCC3)c3nc(C4CC4)ccc3n2)cn1
InChIInChI=1S/C18H19N7O/c19-18-20-9-12(10-21-18)16-23-14-4-3-13(11-1-2-11)22-15(14)17(24-16)25-5-7-26-8-6-25/h3-4,9-11H,1-2,5-8H2,(H2,19,20,21)
InChIKeySHWOWHBLMBPBSX-UHFFFAOYSA-N
XLogP1.78
TPSA102.94 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.40
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

5-(4-morpholin-4-yl-6-propan-2-yloxypyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 53377951
5-(2-cyclopropyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-6-yl)pyrimidin-2-amine
CID 90067938
5-[7-[3-(cyclopropylsulfonylmethyl)phenyl]-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
CID 161224030
4-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-7-yl]-N-methylbenzamide
CID 73057746
5-(9-ethyl-6-morpholin-4-ylpurin-2-yl)pyrimidin-2-amine
CID 143903048
5-(8-ethyl-9-methyl-6-morpholin-4-ylpurin-2-yl)pyrimidin-2-amine
CID 127049341
4-[2-(6-piperidin-4-yl-2-pyridinyl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
CID 168922642
3-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]benzoic acid
CID 25109374
5-(5-methyl-4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 59829304
1-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]ethenol
CID 89235079
5-[9-(cyclopropylmethyl)-6-morpholin-4-yl-8-piperazin-1-ylpurin-2-yl]pyrimidin-2-amine
CID 59333573
5-[6-(2-fluoro-4-pyridinyl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
CID 59829258

Frequently Asked Questions

What is the IUPAC name of 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
The IUPAC name of 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine (CID 58405017) is 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
The canonical SMILES for 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine is Nc1ncc(-c2nc(N3CCOCC3)c3nc(C4CC4)ccc3n2)cn1.
What is the InChIKey of 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
The InChIKey is SHWOWHBLMBPBSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7O/c19-18-20-9-12(10-21-18)16-23-14-4-3-13(11-1-2-11)22-15(14)17(24-16)25-5-7-26-8-6-25/h3-4,9-11H,1-2,5-8H2,(H2,19,20,21).
What are the key properties of 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine?
5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine has a molecular weight of 349.40 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-cyclopropyl-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 58405017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).