6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine

C49H59N19O — CID 158060122

IUPAC6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine
SMILESCc1cccc(C2CCN(c3ccc4ncnc(N)c4n3)CC2)n1.Nc1ncnc2ccc(N3CCC(c4ccn[nH]4)CC3)nc12.Nc1ncnc2ccc(N3CCCC(N4CCOCC4)C3)nc12
InChIInChI=1S/C18H20N6.C16H22N6O.C15H17N7/c1-12-3-2-4-14(22-12)13-7-9-24(10-8-13)16-6-5-15-17(23-16)18(19)21-11-20-15;17-16-15-13(18-11-19-16)3-4-14(20-15)22-5-1-2-12(10-22)21-6-8-23-9-7-21;16-15-14-12(17-9-18-15)1-2-13(20-14)22-7-4-10(5-8-22)11-3-6-19-21-11/h2-6,11,13H,7-10H2,1H3,(H2,19,20,21);3-4,11-12H,1-2,5-10H2,(H2,17,18,19);1-3,6,9-10H,4-5,7-8H2,(H,19,21)(H2,16,17,18)
InChIKeyFKNPQNHLMOARBN-UHFFFAOYSA-N
MW930.14 g/mol
LogP5.32
Rot. Bonds6

About 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine

6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine (PubChem CID 158060122) has the molecular formula C49H59N19O and a molecular weight of 930.14 g/mol. Its IUPAC name is 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine
PubChem CID158060122
Molecular FormulaC49H59N19O
Molecular Weight930.14 g/mol
Exact Mass929.51
IUPAC Name6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine
SMILESCc1cccc(C2CCN(c3ccc4ncnc(N)c4n3)CC2)n1.Nc1ncnc2ccc(N3CCC(c4ccn[nH]4)CC3)nc12.Nc1ncnc2ccc(N3CCCC(N4CCOCC4)C3)nc12
InChIInChI=1S/C18H20N6.C16H22N6O.C15H17N7/c1-12-3-2-4-14(22-12)13-7-9-24(10-8-13)16-6-5-15-17(23-16)18(19)21-11-20-15;17-16-15-13(18-11-19-16)3-4-14(20-15)22-5-1-2-12(10-22)21-6-8-23-9-7-21;16-15-14-12(17-9-18-15)1-2-13(20-14)22-7-4-10(5-8-22)11-3-6-19-21-11/h2-6,11,13H,7-10H2,1H3,(H2,19,20,21);3-4,11-12H,1-2,5-10H2,(H2,17,18,19);1-3,6,9-10H,4-5,7-8H2,(H,19,21)(H2,16,17,18)
InChIKeyFKNPQNHLMOARBN-UHFFFAOYSA-N
XLogP5.32
TPSA257.83 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds6
Heavy Atoms69
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500930.14
LogP ≤ 55.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Analyze 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine?
The IUPAC name of 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine (CID 158060122) is 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine is Cc1cccc(C2CCN(c3ccc4ncnc(N)c4n3)CC2)n1.Nc1ncnc2ccc(N3CCC(c4ccn[nH]4)CC3)nc12.Nc1ncnc2ccc(N3CCCC(N4CCOCC4)C3)nc12.
What is the InChIKey of 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine?
The InChIKey is FKNPQNHLMOARBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6.C16H22N6O.C15H17N7/c1-12-3-2-4-14(22-12)13-7-9-24(10-8-13)16-6-5-15-17(23-16)18(19)21-11-20-15;17-16-15-13(18-11-19-16)3-4-14(20-15)22-5-1-2-12(10-22)21-6-8-23-9-7-21;16-15-14-12(17-9-18-15)1-2-13(20-14)22-7-4-10(5-8-22)11-3-6-19-21-11/h2-6,11,13H,7-10H2,1H3,(H2,19,20,21);3-4,11-12H,1-2,5-10H2,(H2,17,18,19);1-3,6,9-10H,4-5,7-8H2,(H,19,21)(H2,16,17,18).
What are the key properties of 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine?
6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine has a molecular weight of 930.14 g/mol, XLogP of 5.32, 6 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine;6-(3-morpholin-4-ylpiperidin-1-yl)pyrido[3,2-d]pyrimidin-4-amine;6-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrido[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 158060122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).