1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol

C19H29N7O — CID 56902374

About 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol

1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol (PubChem CID 56902374) has the molecular formula C19H29N7O and a molecular weight of 371.49 g/mol. Its IUPAC name is 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol.

Molecular Properties

• Compound Name: 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol
• PubChem CID: 56902374
• Molecular Formula: C19H29N7O
• Molecular Weight: 371.49 g/mol
• Exact Mass: 371.24
• IUPAC Name: 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol
• SMILES: Cc1[nH]cnc1CN1CCc2nc(N(C)C)nc(N3CCC(O)CC3)c2C1
• InChI: InChI=1S/C19H29N7O/c1-13-17(21-12-20-13)11-25-7-6-16-15(10-25)18(23-19(22-16)24(2)3)26-8-4-14(27)5-9-26/h12,14,27H,4-11H2,1-3H3,(H,20,21)
• InChIKey: FTUFSRKWDHXDAN-UHFFFAOYSA-N
• XLogP: 1.09
• TPSA: 84.41 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	371.49
LogP ≤ 5	1.09
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol?

The IUPAC name of 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol (CID 56902374) is 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol.

What is the SMILES notation for 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol?

The canonical SMILES for 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol is Cc1[nH]cnc1CN1CCc2nc(N(C)C)nc(N3CCC(O)CC3)c2C1.

What is the InChIKey of 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol?

The InChIKey is FTUFSRKWDHXDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N7O/c1-13-17(21-12-20-13)11-25-7-6-16-15(10-25)18(23-19(22-16)24(2)3)26-8-4-14(27)5-9-26/h12,14,27H,4-11H2,1-3H3,(H,20,21).

What are the key properties of 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol?

1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol has a molecular weight of 371.49 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-(dimethylamino)-6-[(5-methyl-1H-imidazol-4-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidin-4-ol is sourced from PubChem (CID 56902374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).