1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine

C50H96N4 — CID 159930940

IUPAC1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine
SMILESCC(C)C1CCN(C2CC2)CC1.CC(C)C1CCN(C2CCC2)CC1.CC(C)C1CCN(C2CCCC2)CC1.CC(C)C1CCN(C2CCCCC2)CC1
InChIInChI=1S/C14H27N.C13H25N.C12H23N.C11H21N/c1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-11(2)12-7-9-14(10-8-12)13-5-3-4-6-13;1-10(2)11-6-8-13(9-7-11)12-4-3-5-12;1-9(2)10-5-7-12(8-6-10)11-3-4-11/h12-14H,3-11H2,1-2H3;11-13H,3-10H2,1-2H3;10-12H,3-9H2,1-2H3;9-11H,3-8H2,1-2H3
InChIKeyNZPZAGJBJPKUEI-UHFFFAOYSA-N
MW753.35 g/mol
LogP12.41
Rot. Bonds8

About 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine

1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine (PubChem CID 159930940) has the molecular formula C50H96N4 and a molecular weight of 753.35 g/mol. Its IUPAC name is 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine.

Molecular Properties

Compound Name1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine
PubChem CID159930940
Molecular FormulaC50H96N4
Molecular Weight753.35 g/mol
Exact Mass752.76
IUPAC Name1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine
SMILESCC(C)C1CCN(C2CC2)CC1.CC(C)C1CCN(C2CCC2)CC1.CC(C)C1CCN(C2CCCC2)CC1.CC(C)C1CCN(C2CCCCC2)CC1
InChIInChI=1S/C14H27N.C13H25N.C12H23N.C11H21N/c1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-11(2)12-7-9-14(10-8-12)13-5-3-4-6-13;1-10(2)11-6-8-13(9-7-11)12-4-3-5-12;1-9(2)10-5-7-12(8-6-10)11-3-4-11/h12-14H,3-11H2,1-2H3;11-13H,3-10H2,1-2H3;10-12H,3-9H2,1-2H3;9-11H,3-8H2,1-2H3
InChIKeyNZPZAGJBJPKUEI-UHFFFAOYSA-N
XLogP12.41
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500753.35
LogP ≤ 512.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine with MolForge

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Launch Full Analysis

Related Compounds

(3S,4S)-1-[3-[[(3S,4S)-1-cyclopentyl-3-propan-2-ylpiperidin-4-yl]methyl]cyclobutyl]-4-[3-[(3S,4S)-3-[1-[2-[[(3S)-3-fluoro-3-propan-2-ylpiperidin-1-yl]methyl]cyclopropyl]propan-2-yl]-4-methylpiperidin-1-yl]cyclobutyl]-3-propan-2-ylpiperidine
CID 134204225
1-(3,3-Difluorocyclobutyl)-4-propan-2-ylpiperidine;1-(4,4-difluorocyclohexyl)-4-propan-2-ylpiperidine;1-(3,3-difluorocyclopentyl)-4-propan-2-ylpiperidine;1-(2,2-difluorocyclopropyl)-4-propan-2-ylpiperidine
CID 157065437
1-(Cyclobutylmethyl)-4-propan-2-ylpiperidine;1-(cyclohexylmethyl)-4-propan-2-ylpiperidine;1-(cyclopentylmethyl)-4-propan-2-ylpiperidine;1-(cyclopropylmethyl)-4-propan-2-ylpiperidine
CID 158649559
1-[(1-Methylcyclobutyl)methyl]-4-propan-2-ylpiperidine;1-[(1-methylcyclohexyl)methyl]-4-propan-2-ylpiperidine;1-[(1-methylcyclopentyl)methyl]-4-propan-2-ylpiperidine;1-[(1-methylcyclopropyl)methyl]-4-propan-2-ylpiperidine
CID 159501889
4,4-Dimethyl-1-propan-2-ylpiperidine;8-methyl-6-propan-2-yl-6-azaspiro[2.5]octane;7-propan-2-yl-7-azaspiro[3.5]nonane;6-propan-2-yl-6-azaspiro[2.5]octane
CID 159691847
4,4-Dimethyl-1-propan-2-ylpiperidine;1,4-di(propan-2-yl)piperidine;4-ethyl-4-methyl-1-propan-2-ylpiperidine;2-methyl-1-propan-2-ylpiperidine;4-methyl-1-propan-2-ylpiperidine;6-propan-2-yl-6-azaspiro[2.5]octane;1-propan-2-ylpiperidine
CID 160771818
(2R,4R)-2,4-dimethyl-1-(3-methylbutyl)-3-propan-2-ylpiperidine;1-(3-methylbutyl)-3-propan-2-ylpiperidine;(4S)-4-methyl-1-(3-methylbutyl)-3-propan-2-ylpiperidine;(4R)-4-methyl-1-(3-methylbutyl)-3-propan-2-ylpiperidine;1-(4-methylpentyl)-3-propan-2-ylazetidine
CID 161912388
1-Methyl-1-propylpiperidin-1-ium;1,2,5-trimethyl-1-propylpiperidin-1-ium;1,3,4-trimethyl-1-propylpiperidin-1-ium;1,3,5-trimethyl-1-propylpiperidin-1-ium
CID 162115270
7-[[1-[(1-Methylpiperidin-4-yl)methyl]piperidin-4-yl]methyl]-2-(4-propan-2-ylpiperidin-1-yl)-7-azaspiro[3.5]nonane
CID 168903104
Ethane;7-propan-2-yl-2-(4-propan-2-ylpiperidin-1-yl)-7-azaspiro[3.5]nonane;1-propan-2-yl-4-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 177968007

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine?
The IUPAC name of 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine (CID 159930940) is 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine.
What is the SMILES notation for 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine?
The canonical SMILES for 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine is CC(C)C1CCN(C2CC2)CC1.CC(C)C1CCN(C2CCC2)CC1.CC(C)C1CCN(C2CCCC2)CC1.CC(C)C1CCN(C2CCCCC2)CC1.
What is the InChIKey of 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine?
The InChIKey is NZPZAGJBJPKUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N.C13H25N.C12H23N.C11H21N/c1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-11(2)12-7-9-14(10-8-12)13-5-3-4-6-13;1-10(2)11-6-8-13(9-7-11)12-4-3-5-12;1-9(2)10-5-7-12(8-6-10)11-3-4-11/h12-14H,3-11H2,1-2H3;11-13H,3-10H2,1-2H3;10-12H,3-9H2,1-2H3;9-11H,3-8H2,1-2H3.
What are the key properties of 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine?
1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine has a molecular weight of 753.35 g/mol, XLogP of 12.41, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-4-propan-2-ylpiperidine;1-cyclohexyl-4-propan-2-ylpiperidine;1-cyclopentyl-4-propan-2-ylpiperidine;1-cyclopropyl-4-propan-2-ylpiperidine is sourced from PubChem (CID 159930940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).