2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine

C131H254N16O8 — CID 160950351

About 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine

2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine (PubChem CID 160950351) has the molecular formula C131H254N16O8 and a molecular weight of 2181.58 g/mol. Its IUPAC name is 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
• PubChem CID: 160950351
• Molecular Formula: C131H254N16O8
• Molecular Weight: 2181.58 g/mol
• Exact Mass: 2180.00
• IUPAC Name: 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine
• SMILES: CC(=O)N1CCN(C(C)C)CC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)N1CCC(CN(C)C)CC1.CC(C)N1CCC(N(C)C)CC1.CC(C)N1CCNC(=O)C1.CC(C)N1CCc2[nH]ncc2C1.CC(C)OC(C)C(C)(C)C.CC(C)OC1CCN(C)CC1.CC(C)OCCCN(C)C.CC(C)O[C@H](C)c1ccccc1.CC(C)O[C@H]1CCCC[C@@H]1c1ccccc1.CC(C)c1ccnn1C.CC1CN(C(C)C)CC(C)O1
• InChI: InChI=1S/C15H22O.C11H24N2.C11H16O.C10H22N2.C9H15N3.C9H18N2O.2C9H19NO.C9H20O.C9H18.C8H19NO.C8H16.C7H14N2O.C7H12N2/c1-12(2)16-15-11-7-6-10-14(15)13-8-4-3-5-9-13;1-10(2)13-7-5-11(6-8-13)9-12(3)4;1-9(2)12-10(3)11-7-5-4-6-8-11;1-9(2)12-7-5-10(6-8-12)11(3)4;1-7(2)12-4-3-9-8(6-12)5-10-11-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)11-9-4-6-10(3)7-5-9;1-7(2)10-8(3)9(4,5)6;1-8(2)9-6-4-3-5-7-9;1-8(2)10-7-5-6-9(3)4;1-7(2)8-5-3-4-6-8;1-6(2)9-4-3-8-7(10)5-9;1-6(2)7-4-5-8-9(7)3/h3-5,8-9,12,14-15H,6-7,10-11H2,1-2H3;10-11H,5-9H2,1-4H3;4-10H,1-3H3;9-10H,5-8H2,1-4H3;5,7H,3-4,6H2,1-2H3,(H,10,11);8H,4-7H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7-8H,1-6H3;8-9H,3-7H2,1-2H3;8H,5-7H2,1-4H3;7-8H,3-6H2,1-2H3;6H,3-5H2,1-2H3,(H,8,10);4-6H,1-3H3/t14-,15+;;10-;;;;;;;;;;;/m1.1.........../s1
• InChIKey: SVRDCWFSHLWQAG-ACFFVJONSA-N
• XLogP: 26.78
• TPSA: 183.69 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 21
• Rotatable Bonds: 27
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2181.58
LogP ≤ 5	26.78
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?

The IUPAC name of 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine (CID 160950351) is 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine.

What is the SMILES notation for 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?

The canonical SMILES for 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine is CC(=O)N1CCN(C(C)C)CC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)N1CCC(CN(C)C)CC1.CC(C)N1CCC(N(C)C)CC1.CC(C)N1CCNC(=O)C1.CC(C)N1CCc2[nH]ncc2C1.CC(C)OC(C)C(C)(C)C.CC(C)OC1CCN(C)CC1.CC(C)OCCCN(C)C.CC(C)O[C@H](C)c1ccccc1.CC(C)O[C@H]1CCCC[C@@H]1c1ccccc1.CC(C)c1ccnn1C.CC1CN(C(C)C)CC(C)O1.

What is the InChIKey of 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?

The InChIKey is SVRDCWFSHLWQAG-ACFFVJONSA-N. The full InChI is InChI=1S/C15H22O.C11H24N2.C11H16O.C10H22N2.C9H15N3.C9H18N2O.2C9H19NO.C9H20O.C9H18.C8H19NO.C8H16.C7H14N2O.C7H12N2/c1-12(2)16-15-11-7-6-10-14(15)13-8-4-3-5-9-13;1-10(2)13-7-5-11(6-8-13)9-12(3)4;1-9(2)12-10(3)11-7-5-4-6-8-11;1-9(2)12-7-5-10(6-8-12)11(3)4;1-7(2)12-4-3-9-8(6-12)5-10-11-9;1-8(2)10-4-6-11(7-5-10)9(3)12;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)11-9-4-6-10(3)7-5-9;1-7(2)10-8(3)9(4,5)6;1-8(2)9-6-4-3-5-7-9;1-8(2)10-7-5-6-9(3)4;1-7(2)8-5-3-4-6-8;1-6(2)9-4-3-8-7(10)5-9;1-6(2)7-4-5-8-9(7)3/h3-5,8-9,12,14-15H,6-7,10-11H2,1-2H3;10-11H,5-9H2,1-4H3;4-10H,1-3H3;9-10H,5-8H2,1-4H3;5,7H,3-4,6H2,1-2H3,(H,10,11);8H,4-7H2,1-3H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7-8H,1-6H3;8-9H,3-7H2,1-2H3;8H,5-7H2,1-4H3;7-8H,3-6H2,1-2H3;6H,3-5H2,1-2H3,(H,8,10);4-6H,1-3H3/t14-,15+;;10-;;;;;;;;;;;/m1.1.........../s1.

What are the key properties of 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine?

2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine has a molecular weight of 2181.58 g/mol, XLogP of 26.78, 27 rotatable bonds, 2 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dimethyl-4-propan-2-ylmorpholine;2,2-dimethyl-3-propan-2-yloxybutane;N,N-dimethyl-3-propan-2-yloxypropan-1-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)methanamine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-5-propan-2-ylpyrazole;propan-2-ylcyclohexane;propan-2-ylcyclopentane;[(1R,2S)-2-propan-2-yloxycyclohexyl]benzene;[(1R)-1-propan-2-yloxyethyl]benzene;4-propan-2-ylpiperazin-2-one;1-(4-propan-2-ylpiperazin-1-yl)ethanone;5-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine is sourced from PubChem (CID 160950351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).