2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol

C112H161N19O6 — CID 158646922

About 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol

2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol (PubChem CID 158646922) has the molecular formula C112H161N19O6 and a molecular weight of 1869.65 g/mol. Its IUPAC name is 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol.

Molecular Properties

• Compound Name: 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol
• PubChem CID: 158646922
• Molecular Formula: C112H161N19O6
• Molecular Weight: 1869.65 g/mol
• Exact Mass: 1868.29
• IUPAC Name: 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol
• SMILES: CC(C)c1cc(=O)cc[nH]1.CC(C)c1cc(C#N)ccn1.CC(C)c1cc(N2CCN(CCO)CC2)ccn1.CC(C)c1cc(N2CCOCC2)ccn1.CC(C)c1ccc(C#N)cn1.CC(C)c1ccc(N2CCN(CCO)CC2)cn1.CC(C)c1ccc(N2CCOCC2)cn1.CC(C)c1cccnc1.CC(C)c1ccncc1.COc1cccc(C(C)C)n1.Cc1ccc(C(C)C)nc1
• InChI: InChI=1S/2C14H23N3O.2C12H18N2O.2C9H10N2.C9H13NO.C9H13N.C8H11NO.2C8H11N/c1-12(2)14-11-13(3-4-15-14)17-7-5-16(6-8-17)9-10-18;1-12(2)14-4-3-13(11-15-14)17-7-5-16(6-8-17)9-10-18;1-10(2)12-9-11(3-4-13-12)14-5-7-15-8-6-14;1-10(2)12-4-3-11(9-13-12)14-5-7-15-8-6-14;1-7(2)9-5-8(6-10)3-4-11-9;1-7(2)9-4-3-8(5-10)6-11-9;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)6-10-9;1-6(2)8-5-7(10)3-4-9-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8/h2*3-4,11-12,18H,5-10H2,1-2H3;2*3-4,9-10H,5-8H2,1-2H3;3-5,7H,1-2H3;3-4,6-7H,1-2H3;4-7H,1-3H3;4-7H,1-3H3;3-6H,1-2H3,(H,9,10);2*3-7H,1-2H3
• InChIKey: IBBSESLVDNILAJ-UHFFFAOYSA-N
• XLogP: 21.51
• TPSA: 296.93 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 24
• Rotatable Bonds: 20
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1869.65
LogP ≤ 5	21.51
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol?

The IUPAC name of 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol (CID 158646922) is 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol.

What is the SMILES notation for 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol?

The canonical SMILES for 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol is CC(C)c1cc(=O)cc[nH]1.CC(C)c1cc(C#N)ccn1.CC(C)c1cc(N2CCN(CCO)CC2)ccn1.CC(C)c1cc(N2CCOCC2)ccn1.CC(C)c1ccc(C#N)cn1.CC(C)c1ccc(N2CCN(CCO)CC2)cn1.CC(C)c1ccc(N2CCOCC2)cn1.CC(C)c1cccnc1.CC(C)c1ccncc1.COc1cccc(C(C)C)n1.Cc1ccc(C(C)C)nc1.

What is the InChIKey of 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol?

The InChIKey is IBBSESLVDNILAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H23N3O.2C12H18N2O.2C9H10N2.C9H13NO.C9H13N.C8H11NO.2C8H11N/c1-12(2)14-11-13(3-4-15-14)17-7-5-16(6-8-17)9-10-18;1-12(2)14-4-3-13(11-15-14)17-7-5-16(6-8-17)9-10-18;1-10(2)12-9-11(3-4-13-12)14-5-7-15-8-6-14;1-10(2)12-4-3-11(9-13-12)14-5-7-15-8-6-14;1-7(2)9-5-8(6-10)3-4-11-9;1-7(2)9-4-3-8(5-10)6-11-9;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)6-10-9;1-6(2)8-5-7(10)3-4-9-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8/h2*3-4,11-12,18H,5-10H2,1-2H3;2*3-4,9-10H,5-8H2,1-2H3;3-5,7H,1-2H3;3-4,6-7H,1-2H3;4-7H,1-3H3;4-7H,1-3H3;3-6H,1-2H3,(H,9,10);2*3-7H,1-2H3.

What are the key properties of 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol?

2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol has a molecular weight of 1869.65 g/mol, XLogP of 21.51, 20 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methoxy-6-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carbonitrile;6-propan-2-ylpyridine-3-carbonitrile;2-propan-2-yl-1H-pyridin-4-one;4-(2-propan-2-yl-4-pyridinyl)morpholine;4-(6-propan-2-yl-3-pyridinyl)morpholine;2-[4-(2-propan-2-yl-4-pyridinyl)piperazin-1-yl]ethanol;2-[4-(6-propan-2-yl-3-pyridinyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 158646922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).