2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine

C127H199ClF2N32O12 — CID 159823175

About 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine

2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine (PubChem CID 159823175) has the molecular formula C127H199ClF2N32O12 and a molecular weight of 2439.65 g/mol. Its IUPAC name is 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine.

Molecular Properties

• Compound Name: 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine
• PubChem CID: 159823175
• Molecular Formula: C127H199ClF2N32O12
• Molecular Weight: 2439.65 g/mol
• Exact Mass: 2437.56
• IUPAC Name: 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine
• SMILES: CC(C)c1cc(N2CCC(O)CC2)ncn1.CC(C)c1ccc(N2CCOCC2)nn1.CC(C)c1cnc(N2CCOCC2)cn1.COC(=O)c1ccc(C(C)C)nn1.COc1nccc(C(C)C)n1.Cc1cc(C(C)C)nc(C(F)F)n1.Cc1cc(C(C)C)nc(Cl)n1.Cc1cc(C(C)C)nc(N(C)C)n1.Cc1cc(C(C)C)nc(N(C)CCO)n1.Cc1cc(C(C)C)nc(N(CCO)CCO)n1.Cc1cc(C(C)C)nc(N2C(CO)CCC2CO)n1.Cc1cc(C(C)C)nc(N2CCOCC2)n1
• InChI: InChI=1S/C14H23N3O2.C12H21N3O2.2C12H19N3O.2C11H17N3O.C11H19N3O.C10H17N3.C9H12F2N2.C9H12N2O2.C8H11ClN2.C8H12N2O/c1-9(2)13-6-10(3)15-14(16-13)17-11(7-18)4-5-12(17)8-19;1-9(2)11-8-10(3)13-12(14-11)15(4-6-16)5-7-17;1-9(2)11-8-10(3)13-12(14-11)15-4-6-16-7-5-15;1-9(2)11-7-12(14-8-13-11)15-5-3-10(16)4-6-15;1-9(2)10-7-13-11(8-12-10)14-3-5-15-6-4-14;1-9(2)10-3-4-11(13-12-10)14-5-7-15-8-6-14;1-8(2)10-7-9(3)12-11(13-10)14(4)5-6-15;1-7(2)9-6-8(3)11-10(12-9)13(4)5;1-5(2)7-4-6(3)12-9(13-7)8(10)11;1-6(2)7-4-5-8(11-10-7)9(12)13-3;1-5(2)7-4-6(3)10-8(9)11-7;1-6(2)7-4-5-9-8(10-7)11-3/h6,9,11-12,18-19H,4-5,7-8H2,1-3H3;8-9,16-17H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;7-10,16H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;3-4,9H,5-8H2,1-2H3;7-8,15H,5-6H2,1-4H3;6-7H,1-5H3;4-5,8H,1-3H3;4-6H,1-3H3;4-5H,1-3H3;4-6H,1-3H3
• InChIKey: NMMQSMFYVYSQAB-UHFFFAOYSA-N
• XLogP: 19.82
• TPSA: 519.88 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 44
• Rotatable Bonds: 31
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2439.65
LogP ≤ 5	19.82
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	44

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine?

The IUPAC name of 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine (CID 159823175) is 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine.

What is the SMILES notation for 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine?

The canonical SMILES for 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine is CC(C)c1cc(N2CCC(O)CC2)ncn1.CC(C)c1ccc(N2CCOCC2)nn1.CC(C)c1cnc(N2CCOCC2)cn1.COC(=O)c1ccc(C(C)C)nn1.COc1nccc(C(C)C)n1.Cc1cc(C(C)C)nc(C(F)F)n1.Cc1cc(C(C)C)nc(Cl)n1.Cc1cc(C(C)C)nc(N(C)C)n1.Cc1cc(C(C)C)nc(N(C)CCO)n1.Cc1cc(C(C)C)nc(N(CCO)CCO)n1.Cc1cc(C(C)C)nc(N2C(CO)CCC2CO)n1.Cc1cc(C(C)C)nc(N2CCOCC2)n1.

What is the InChIKey of 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine?

The InChIKey is NMMQSMFYVYSQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2.C12H21N3O2.2C12H19N3O.2C11H17N3O.C11H19N3O.C10H17N3.C9H12F2N2.C9H12N2O2.C8H11ClN2.C8H12N2O/c1-9(2)13-6-10(3)15-14(16-13)17-11(7-18)4-5-12(17)8-19;1-9(2)11-8-10(3)13-12(14-11)15(4-6-16)5-7-17;1-9(2)11-8-10(3)13-12(14-11)15-4-6-16-7-5-15;1-9(2)11-7-12(14-8-13-11)15-5-3-10(16)4-6-15;1-9(2)10-7-13-11(8-12-10)14-3-5-15-6-4-14;1-9(2)10-3-4-11(13-12-10)14-5-7-15-8-6-14;1-8(2)10-7-9(3)12-11(13-10)14(4)5-6-15;1-7(2)9-6-8(3)11-10(12-9)13(4)5;1-5(2)7-4-6(3)12-9(13-7)8(10)11;1-6(2)7-4-5-8(11-10-7)9(12)13-3;1-5(2)7-4-6(3)10-8(9)11-7;1-6(2)7-4-5-9-8(10-7)11-3/h6,9,11-12,18-19H,4-5,7-8H2,1-3H3;8-9,16-17H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;7-10,16H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;3-4,9H,5-8H2,1-2H3;7-8,15H,5-6H2,1-4H3;6-7H,1-5H3;4-5,8H,1-3H3;4-6H,1-3H3;4-5H,1-3H3;4-6H,1-3H3.

What are the key properties of 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine?

2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine has a molecular weight of 2439.65 g/mol, XLogP of 19.82, 31 rotatable bonds, 6 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-4-methyl-6-propan-2-ylpyrimidine;2-(difluoromethyl)-4-methyl-6-propan-2-ylpyrimidine;2-[2-hydroxyethyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;[5-(hydroxymethyl)-1-(4-methyl-6-propan-2-ylpyrimidin-2-yl)pyrrolidin-2-yl]methanol;2-methoxy-4-propan-2-ylpyrimidine;2-[methyl-(4-methyl-6-propan-2-ylpyrimidin-2-yl)amino]ethanol;methyl 6-propan-2-ylpyridazine-3-carboxylate;4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)morpholine;4-(5-propan-2-ylpyrazin-2-yl)morpholine;4-(6-propan-2-ylpyridazin-3-yl)morpholine;1-(6-propan-2-ylpyrimidin-4-yl)piperidin-4-ol;N,N,4-trimethyl-6-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 159823175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).