3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine

C56H119N7O3 — CID 158188838

IUPAC3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine
SMILESCC(C)CN1CCC(OC(C)C)CC1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCOCC1.CC(C)N1CCCCC1.CC1CCN(C(C)C)CC1.COC1CCCN(CC(C)C)C1
InChIInChI=1S/C12H25NO.C10H21NO.C9H20N2.C9H19N.C8H17NO.C8H17N/c1-10(2)9-13-7-5-12(6-8-13)14-11(3)4;1-9(2)7-11-6-4-5-10(8-11)12-3;1-9(2)8-11-6-4-10(3)5-7-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)9-6-4-3-5-7-9/h10-12H,5-9H2,1-4H3;9-10H,4-8H2,1-3H3;9H,4-8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3
InChIKeyFZMIYBSLUAKHBZ-UHFFFAOYSA-N
MW938.61 g/mol
LogP10.16
Rot. Bonds13

About 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine

3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine (PubChem CID 158188838) has the molecular formula C56H119N7O3 and a molecular weight of 938.61 g/mol. Its IUPAC name is 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine.

Molecular Properties

Compound Name3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine
PubChem CID158188838
Molecular FormulaC56H119N7O3
Molecular Weight938.61 g/mol
Exact Mass937.94
IUPAC Name3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine
SMILESCC(C)CN1CCC(OC(C)C)CC1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCOCC1.CC(C)N1CCCCC1.CC1CCN(C(C)C)CC1.COC1CCCN(CC(C)C)C1
InChIInChI=1S/C12H25NO.C10H21NO.C9H20N2.C9H19N.C8H17NO.C8H17N/c1-10(2)9-13-7-5-12(6-8-13)14-11(3)4;1-9(2)7-11-6-4-5-10(8-11)12-3;1-9(2)8-11-6-4-10(3)5-7-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)9-6-4-3-5-7-9/h10-12H,5-9H2,1-4H3;9-10H,4-8H2,1-3H3;9H,4-8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3
InChIKeyFZMIYBSLUAKHBZ-UHFFFAOYSA-N
XLogP10.16
TPSA50.37 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500938.61
LogP ≤ 510.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine?
The IUPAC name of 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine (CID 158188838) is 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine.
What is the SMILES notation for 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine?
The canonical SMILES for 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine is CC(C)CN1CCC(OC(C)C)CC1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCOCC1.CC(C)N1CCCCC1.CC1CCN(C(C)C)CC1.COC1CCCN(CC(C)C)C1.
What is the InChIKey of 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine?
The InChIKey is FZMIYBSLUAKHBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO.C10H21NO.C9H20N2.C9H19N.C8H17NO.C8H17N/c1-10(2)9-13-7-5-12(6-8-13)14-11(3)4;1-9(2)7-11-6-4-5-10(8-11)12-3;1-9(2)8-11-6-4-10(3)5-7-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)9-6-4-3-5-7-9/h10-12H,5-9H2,1-4H3;9-10H,4-8H2,1-3H3;9H,4-8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3.
What are the key properties of 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine?
3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine has a molecular weight of 938.61 g/mol, XLogP of 10.16, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(2-methylpropyl)piperidine;1-methyl-4-(2-methylpropyl)piperazine;4-methyl-1-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)-4-propan-2-yloxypiperidine;1-propan-2-ylpiperidine is sourced from PubChem (CID 158188838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).