[4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine

C49H70Cl3N17O6 — CID 159484740

About [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine

[4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine (PubChem CID 159484740) has the molecular formula C49H70Cl3N17O6 and a molecular weight of 1099.57 g/mol. Its IUPAC name is [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine.

Molecular Properties

• Compound Name: [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine
• PubChem CID: 159484740
• Molecular Formula: C49H70Cl3N17O6
• Molecular Weight: 1099.57 g/mol
• Exact Mass: 1097.48
• IUPAC Name: [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine
• SMILES: C1CCNCC1.Cc1ccn(-c2nc(Cl)cc(Cl)n2)n1.Cc1ccn(-c2nc(Cl)cc(N3CCOC(CO)C3)n2)n1.Cc1ccn(-c2nc(N3CCCCC3)cc(N3CCOC(CO)C3)n2)n1.OCC1CNCCO1
• InChI: InChI=1S/C18H26N6O2.C13H16ClN5O2.C8H6Cl2N4.C5H11NO2.C5H11N/c1-14-5-8-24(21-14)18-19-16(22-6-3-2-4-7-22)11-17(20-18)23-9-10-26-15(12-23)13-25;1-9-2-3-19(17-9)13-15-11(14)6-12(16-13)18-4-5-21-10(7-18)8-20;1-5-2-3-14(13-5)8-11-6(9)4-7(10)12-8;7-4-5-3-6-1-2-8-5;1-2-4-6-5-3-1/h5,8,11,15,25H,2-4,6-7,9-10,12-13H2,1H3;2-3,6,10,20H,4-5,7-8H2,1H3;2-4H,1H3;5-7H,1-4H2;6H,1-5H2
• InChIKey: LXLBYOOQBOJVMB-UHFFFAOYSA-N
• XLogP: 3.98
• TPSA: 252.96 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 23
• Rotatable Bonds: 9
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1099.57
LogP ≤ 5	3.98
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine?

The IUPAC name of [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine (CID 159484740) is [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine.

What is the SMILES notation for [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine?

The canonical SMILES for [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine is C1CCNCC1.Cc1ccn(-c2nc(Cl)cc(Cl)n2)n1.Cc1ccn(-c2nc(Cl)cc(N3CCOC(CO)C3)n2)n1.Cc1ccn(-c2nc(N3CCCCC3)cc(N3CCOC(CO)C3)n2)n1.OCC1CNCCO1.

What is the InChIKey of [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine?

The InChIKey is LXLBYOOQBOJVMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O2.C13H16ClN5O2.C8H6Cl2N4.C5H11NO2.C5H11N/c1-14-5-8-24(21-14)18-19-16(22-6-3-2-4-7-22)11-17(20-18)23-9-10-26-15(12-23)13-25;1-9-2-3-19(17-9)13-15-11(14)6-12(16-13)18-4-5-21-10(7-18)8-20;1-5-2-3-14(13-5)8-11-6(9)4-7(10)12-8;7-4-5-3-6-1-2-8-5;1-2-4-6-5-3-1/h5,8,11,15,25H,2-4,6-7,9-10,12-13H2,1H3;2-3,6,10,20H,4-5,7-8H2,1H3;2-4H,1H3;5-7H,1-4H2;6H,1-5H2.

What are the key properties of [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine?

[4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine has a molecular weight of 1099.57 g/mol, XLogP of 3.98, 9 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[6-chloro-2-(3-methylpyrazol-1-yl)pyrimidin-4-yl]morpholin-2-yl]methanol;4,6-dichloro-2-(3-methylpyrazol-1-yl)pyrimidine;[4-[2-(3-methylpyrazol-1-yl)-6-piperidin-1-ylpyrimidin-4-yl]morpholin-2-yl]methanol;morpholin-2-ylmethanol;piperidine is sourced from PubChem (CID 159484740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).