(5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine

C110H166N30O8 — CID 159000958

About (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine

(5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine (PubChem CID 159000958) has the molecular formula C110H166N30O8 and a molecular weight of 2036.74 g/mol. Its IUPAC name is (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine.

Molecular Properties

• Compound Name: (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine
• PubChem CID: 159000958
• Molecular Formula: C110H166N30O8
• Molecular Weight: 2036.74 g/mol
• Exact Mass: 2035.35
• IUPAC Name: (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine
• SMILES: C=C(C)CC[C@@](C)(CCCC)Nc1nc(N)nc2cc(CC)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(C(C)C)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(O)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(OC)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(OCC)cnc12.CCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cccnc12
• InChI: InChI=1S/C20H31N5O.C20H31N5.C19H29N5O2.C18H27N5O2.C17H25N5O2.C16H23N5O/c1-6-7-9-20(5,10-8-14(4)26)25-18-17-16(23-19(21)24-18)11-15(12-22-17)13(2)3;1-6-8-10-20(5,11-9-14(3)4)25-18-17-16(23-19(21)24-18)12-15(7-2)13-22-17;1-5-7-9-19(4,10-8-13(3)25)24-17-16-15(22-18(20)23-17)11-14(12-21-16)26-6-2;1-5-6-8-18(3,9-7-12(2)24)23-16-15-14(21-17(19)22-16)10-13(25-4)11-20-15;1-4-5-7-17(3,8-6-11(2)23)22-15-14-13(20-16(18)21-15)9-12(24)10-19-14;1-4-8-16(3,9-7-11(2)22)21-14-13-12(6-5-10-18-13)19-15(17)20-14/h11-13H,6-10H2,1-5H3,(H3,21,23,24,25);12-13H,3,6-11H2,1-2,4-5H3,(H3,21,23,24,25);11-12H,5-10H2,1-4H3,(H3,20,22,23,24);10-11H,5-9H2,1-4H3,(H3,19,21,22,23);9-10,24H,4-8H2,1-3H3,(H3,18,20,21,22);5-6,10H,4,7-9H2,1-3H3,(H3,17,19,20,21)/t2*20-;19-;18-;17-;16-/m111111/s1
• InChIKey: JRIDVEFCKIYPOK-UQNQQKBQSA-N
• XLogP: 22.42
• TPSA: 584.36 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 38
• Rotatable Bonds: 52
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2036.74
LogP ≤ 5	22.42
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine?

The IUPAC name of (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine (CID 159000958) is (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine.

What is the SMILES notation for (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine?

The canonical SMILES for (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine is C=C(C)CC[C@@](C)(CCCC)Nc1nc(N)nc2cc(CC)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(C(C)C)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(O)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(OC)cnc12.CCCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cc(OCC)cnc12.CCC[C@](C)(CCC(C)=O)Nc1nc(N)nc2cccnc12.

What is the InChIKey of (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine?

The InChIKey is JRIDVEFCKIYPOK-UQNQQKBQSA-N. The full InChI is InChI=1S/C20H31N5O.C20H31N5.C19H29N5O2.C18H27N5O2.C17H25N5O2.C16H23N5O/c1-6-7-9-20(5,10-8-14(4)26)25-18-17-16(23-19(21)24-18)11-15(12-22-17)13(2)3;1-6-8-10-20(5,11-9-14(3)4)25-18-17-16(23-19(21)24-18)12-15(7-2)13-22-17;1-5-7-9-19(4,10-8-13(3)25)24-17-16-15(22-18(20)23-17)11-14(12-21-16)26-6-2;1-5-6-8-18(3,9-7-12(2)24)23-16-15-14(21-17(19)22-16)10-13(25-4)11-20-15;1-4-5-7-17(3,8-6-11(2)23)22-15-14-13(20-16(18)21-15)9-12(24)10-19-14;1-4-8-16(3,9-7-11(2)22)21-14-13-12(6-5-10-18-13)19-15(17)20-14/h11-13H,6-10H2,1-5H3,(H3,21,23,24,25);12-13H,3,6-11H2,1-2,4-5H3,(H3,21,23,24,25);11-12H,5-10H2,1-4H3,(H3,20,22,23,24);10-11H,5-9H2,1-4H3,(H3,19,21,22,23);9-10,24H,4-8H2,1-3H3,(H3,18,20,21,22);5-6,10H,4,7-9H2,1-3H3,(H3,17,19,20,21)/t2*20-;19-;18-;17-;16-/m111111/s1.

What are the key properties of (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine?

(5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine has a molecular weight of 2036.74 g/mol, XLogP of 22.42, 52 rotatable bonds, 13 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-5-[(2-amino-7-ethoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-hydroxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-methoxypyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-amino-7-propan-2-ylpyrido[3,2-d]pyrimidin-4-yl)amino]-5-methylnonan-2-one;(5R)-5-[(2-aminopyrido[3,2-d]pyrimidin-4-yl)amino]-5-methyloctan-2-one;4-N-[(5R)-2,5-dimethylnon-1-en-5-yl]-7-ethylpyrido[3,2-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 159000958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).