1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine

C150H290N18 — CID 167684655

IUPAC1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine
SMILESC1CCC(CN2CCC2)CC1.C1CCC(CN2CCCC2)CC1.C1CCC(CN2CCCC2)CC1.C1CCC(CN2CCCCC2)CC1.C1CCC(CN2CCCCC2)CC1.C1CCC(N2CCCC2)CC1.CC1CCN(C2CN(C)C2)CC1.CC1CN(C2CCCCC2)C1.CCC1CN(C2CCCCC2)C1.CCN1CC(N2CCC(C)CC2)C1.CCN1CC(N2CCCCC2)C1.CCN1CCC2(CCCCC2)CC1.CN1CC(N2CCCCC2)C1.CN1CCC2(CCCCC2)CC1
InChIInChI=1S/3C12H23N.C11H22N2.4C11H21N.2C10H20N2.3C10H19N.C9H18N2/c2*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-13-10-8-12(9-11-13)6-4-3-5-7-12;1-3-12-8-11(9-12)13-6-4-10(2)5-7-13;1-12-9-7-11(8-10-12)5-3-2-4-6-11;1-2-10-8-12(9-10)11-6-4-3-5-7-11;2*1-2-6-11(7-3-1)10-12-8-4-5-9-12;1-9-3-5-12(6-4-9)10-7-11(2)8-10;1-2-11-8-10(9-11)12-6-4-3-5-7-12;1-9-7-11(8-9)10-5-3-2-4-6-10;1-2-6-10(7-3-1)11-8-4-5-9-11;1-2-5-10(6-3-1)9-11-7-4-8-11;1-10-7-9(8-10)11-5-3-2-4-6-11/h2*12H,1-11H2;2-11H2,1H3;10-11H,3-9H2,1-2H3;2-10H2,1H3;10-11H,2-9H2,1H3;2*11H,1-10H2;9-10H,3-8H2,1-2H3;10H,2-9H2,1H3;9-10H,2-8H2,1H3;2*10H,1-9H2;9H,2-8H2,1H3
InChIKeyWARJNKCMXUGZQY-UHFFFAOYSA-N
MW2346.10 g/mol
LogP31.18
Rot. Bonds21

About 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine

1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine (PubChem CID 167684655) has the molecular formula C150H290N18 and a molecular weight of 2346.10 g/mol. Its IUPAC name is 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine.

Molecular Properties

Compound Name1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine
PubChem CID167684655
Molecular FormulaC150H290N18
Molecular Weight2346.10 g/mol
Exact Mass2344.32
IUPAC Name1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine
SMILESC1CCC(CN2CCC2)CC1.C1CCC(CN2CCCC2)CC1.C1CCC(CN2CCCC2)CC1.C1CCC(CN2CCCCC2)CC1.C1CCC(CN2CCCCC2)CC1.C1CCC(N2CCCC2)CC1.CC1CCN(C2CN(C)C2)CC1.CC1CN(C2CCCCC2)C1.CCC1CN(C2CCCCC2)C1.CCN1CC(N2CCC(C)CC2)C1.CCN1CC(N2CCCCC2)C1.CCN1CCC2(CCCCC2)CC1.CN1CC(N2CCCCC2)C1.CN1CCC2(CCCCC2)CC1
InChIInChI=1S/3C12H23N.C11H22N2.4C11H21N.2C10H20N2.3C10H19N.C9H18N2/c2*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-13-10-8-12(9-11-13)6-4-3-5-7-12;1-3-12-8-11(9-12)13-6-4-10(2)5-7-13;1-12-9-7-11(8-10-12)5-3-2-4-6-11;1-2-10-8-12(9-10)11-6-4-3-5-7-11;2*1-2-6-11(7-3-1)10-12-8-4-5-9-12;1-9-3-5-12(6-4-9)10-7-11(2)8-10;1-2-11-8-10(9-11)12-6-4-3-5-7-12;1-9-7-11(8-9)10-5-3-2-4-6-10;1-2-6-10(7-3-1)11-8-4-5-9-11;1-2-5-10(6-3-1)9-11-7-4-8-11;1-10-7-9(8-10)11-5-3-2-4-6-11/h2*12H,1-11H2;2-11H2,1H3;10-11H,3-9H2,1-2H3;2-10H2,1H3;10-11H,2-9H2,1H3;2*11H,1-10H2;9-10H,3-8H2,1-2H3;10H,2-9H2,1H3;9-10H,2-8H2,1H3;2*10H,1-9H2;9H,2-8H2,1H3
InChIKeyWARJNKCMXUGZQY-UHFFFAOYSA-N
XLogP31.18
TPSA58.32 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds21
Heavy Atoms168
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002346.10
LogP ≤ 531.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine?
The IUPAC name of 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine (CID 167684655) is 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine.
What is the SMILES notation for 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine?
The canonical SMILES for 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine is C1CCC(CN2CCC2)CC1.C1CCC(CN2CCCC2)CC1.C1CCC(CN2CCCC2)CC1.C1CCC(CN2CCCCC2)CC1.C1CCC(CN2CCCCC2)CC1.C1CCC(N2CCCC2)CC1.CC1CCN(C2CN(C)C2)CC1.CC1CN(C2CCCCC2)C1.CCC1CN(C2CCCCC2)C1.CCN1CC(N2CCC(C)CC2)C1.CCN1CC(N2CCCCC2)C1.CCN1CCC2(CCCCC2)CC1.CN1CC(N2CCCCC2)C1.CN1CCC2(CCCCC2)CC1.
What is the InChIKey of 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine?
The InChIKey is WARJNKCMXUGZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H23N.C11H22N2.4C11H21N.2C10H20N2.3C10H19N.C9H18N2/c2*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-13-10-8-12(9-11-13)6-4-3-5-7-12;1-3-12-8-11(9-12)13-6-4-10(2)5-7-13;1-12-9-7-11(8-10-12)5-3-2-4-6-11;1-2-10-8-12(9-10)11-6-4-3-5-7-11;2*1-2-6-11(7-3-1)10-12-8-4-5-9-12;1-9-3-5-12(6-4-9)10-7-11(2)8-10;1-2-11-8-10(9-11)12-6-4-3-5-7-12;1-9-7-11(8-9)10-5-3-2-4-6-10;1-2-6-10(7-3-1)11-8-4-5-9-11;1-2-5-10(6-3-1)9-11-7-4-8-11;1-10-7-9(8-10)11-5-3-2-4-6-11/h2*12H,1-11H2;2-11H2,1H3;10-11H,3-9H2,1-2H3;2-10H2,1H3;10-11H,2-9H2,1H3;2*11H,1-10H2;9-10H,3-8H2,1-2H3;10H,2-9H2,1H3;9-10H,2-8H2,1H3;2*10H,1-9H2;9H,2-8H2,1H3.
What are the key properties of 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine?
1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine has a molecular weight of 2346.10 g/mol, XLogP of 31.18, 21 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-ethylazetidine;1-(cyclohexylmethyl)azetidine;1-cyclohexyl-3-methylazetidine;bis(1-(cyclohexylmethyl)piperidine);bis(1-(cyclohexylmethyl)pyrrolidine);1-cyclohexylpyrrolidine;3-ethyl-3-azaspiro[5.5]undecane;1-(1-ethylazetidin-3-yl)-4-methylpiperidine;1-(1-ethylazetidin-3-yl)piperidine;3-methyl-3-azaspiro[5.5]undecane;1-(1-methylazetidin-3-yl)piperidine;4-methyl-1-(1-methylazetidin-3-yl)piperidine is sourced from PubChem (CID 167684655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).