1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol

C121H232F3N33O8 — CID 160942454

About 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol

1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol (PubChem CID 160942454) has the molecular formula C121H232F3N33O8 and a molecular weight of 2334.40 g/mol. Its IUPAC name is 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol.

Molecular Properties

• Compound Name: 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol
• PubChem CID: 160942454
• Molecular Formula: C121H232F3N33O8
• Molecular Weight: 2334.40 g/mol
• Exact Mass: 2332.87
• IUPAC Name: 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol
• SMILES: CC1CCCN(C)C1.CN1CC2CCC(C1)N2C.CN1CCN(C)C(=O)C1.CN1CCN(C)C(C)(C)C1.CN1CCN(C2CCC2)CC1.CN1CCN(C2COC2)CC1.CN1CCN(CC(=O)N2CCCC2)CC1.CN1CCN(CC(N)=O)CC1.CN1CCN(CC(O)C(F)(F)F)CC1.CN1CCN(c2ccccn2)CC1.CN1CCc2c(ncn2C)C1.CN1Cc2cccnc2C1.COCC1CN(C)CCN1C.COCCN(C)C.COCCn1cnc2c1CCN(C)C2
• InChI: InChI=1S/C11H21N3O.C10H17N3O.C10H15N3.C9H18N2.C8H15F3N2O.C8H13N3.C8H16N2O.C8H18N2O.C8H16N2.C8H10N2.C8H18N2.C7H15N3O.C7H15N.C6H12N2O.C5H13NO/c1-12-6-8-13(9-7-12)10-11(15)14-4-2-3-5-14;1-12-4-3-10-9(7-12)11-8-13(10)5-6-14-2;1-12-6-8-13(9-7-12)10-4-2-3-5-11-10;1-10-5-7-11(8-6-10)9-3-2-4-9;1-12-2-4-13(5-3-12)6-7(14)8(9,10)11;1-10-4-3-8-7(5-10)9-6-11(8)2;1-9-2-4-10(5-3-9)8-6-11-7-8;1-9-4-5-10(2)8(6-9)7-11-3;1-9-5-7-3-4-8(6-9)10(7)2;1-10-5-7-3-2-4-9-8(7)6-10;1-8(2)7-9(3)5-6-10(8)4;1-9-2-4-10(5-3-9)6-7(8)11;1-7-4-3-5-8(2)6-7;1-7-3-4-8(2)6(9)5-7;1-6(2)4-5-7-3/h2-10H2,1H3;8H,3-7H2,1-2H3;2-5H,6-9H2,1H3;9H,2-8H2,1H3;7,14H,2-6H2,1H3;6H,3-5H2,1-2H3;8H,2-7H2,1H3;8H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;2-4H,5-6H2,1H3;5-7H2,1-4H3;2-6H2,1H3,(H2,8,11);7H,3-6H2,1-2H3;3-5H2,1-2H3;4-5H2,1-3H3
• InChIKey: SURGLPCTODXOAJ-UHFFFAOYSA-N
• XLogP: 3.79
• TPSA: 280.04 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 38
• Rotatable Bonds: 17
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2334.40
LogP ≤ 5	3.79
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol?

The IUPAC name of 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol (CID 160942454) is 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol.

What is the SMILES notation for 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol?

The canonical SMILES for 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol is CC1CCCN(C)C1.CN1CC2CCC(C1)N2C.CN1CCN(C)C(=O)C1.CN1CCN(C)C(C)(C)C1.CN1CCN(C2CCC2)CC1.CN1CCN(C2COC2)CC1.CN1CCN(CC(=O)N2CCCC2)CC1.CN1CCN(CC(N)=O)CC1.CN1CCN(CC(O)C(F)(F)F)CC1.CN1CCN(c2ccccn2)CC1.CN1CCc2c(ncn2C)C1.CN1Cc2cccnc2C1.COCC1CN(C)CCN1C.COCCN(C)C.COCCn1cnc2c1CCN(C)C2.

What is the InChIKey of 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol?

The InChIKey is SURGLPCTODXOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O.C10H17N3O.C10H15N3.C9H18N2.C8H15F3N2O.C8H13N3.C8H16N2O.C8H18N2O.C8H16N2.C8H10N2.C8H18N2.C7H15N3O.C7H15N.C6H12N2O.C5H13NO/c1-12-6-8-13(9-7-12)10-11(15)14-4-2-3-5-14;1-12-4-3-10-9(7-12)11-8-13(10)5-6-14-2;1-12-6-8-13(9-7-12)10-4-2-3-5-11-10;1-10-5-7-11(8-6-10)9-3-2-4-9;1-12-2-4-13(5-3-12)6-7(14)8(9,10)11;1-10-4-3-8-7(5-10)9-6-11(8)2;1-9-2-4-10(5-3-9)8-6-11-7-8;1-9-4-5-10(2)8(6-9)7-11-3;1-9-5-7-3-4-8(6-9)10(7)2;1-10-5-7-3-2-4-9-8(7)6-10;1-8(2)7-9(3)5-6-10(8)4;1-9-2-4-10(5-3-9)6-7(8)11;1-7-4-3-5-8(2)6-7;1-7-3-4-8(2)6(9)5-7;1-6(2)4-5-7-3/h2-10H2,1H3;8H,3-7H2,1-2H3;2-5H,6-9H2,1H3;9H,2-8H2,1H3;7,14H,2-6H2,1H3;6H,3-5H2,1-2H3;8H,2-7H2,1H3;8H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;2-4H,5-6H2,1H3;5-7H2,1-4H3;2-6H2,1H3,(H2,8,11);7H,3-6H2,1-2H3;3-5H2,1-2H3;4-5H2,1-3H3.

What are the key properties of 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol?

1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol has a molecular weight of 2334.40 g/mol, XLogP of 3.79, 17 rotatable bonds, 2 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclobutyl-4-methylpiperazine;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane;1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1,4-dimethylpiperazin-2-one;1,3-dimethylpiperidine;2-methoxy-N,N-dimethylethanamine;1-(2-methoxyethyl)-5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;2-(methoxymethyl)-1,4-dimethylpiperazine;6-methyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-methyl-4-(oxetan-3-yl)piperazine;2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone;1-methyl-4-pyridin-2-ylpiperazine;1,2,2,4-tetramethylpiperazine;1,1,1-trifluoro-3-(4-methylpiperazin-1-yl)propan-2-ol is sourced from PubChem (CID 160942454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).