4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one

C72H143N7O4 — CID 158034861

IUPAC4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one
SMILESCC(=O)N1CCC(CC(C)(C)C)CC1.CCC(=O)N1CCC(C(C)(C)C)CC1.CCC(=O)N1CCC(CC(C)(C)C)CC1.CCCN1CCC(C(C)(C)C)CC1.CCN1CCC(C(C)(C)C)CC1.CN(C)C(=O)N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C13H25NO.C12H24N2O.2C12H23NO.C12H25N.C11H23N/c1-5-12(15)14-8-6-11(7-9-14)10-13(2,3)4;1-12(2,3)10-6-8-14(9-7-10)11(15)13(4)5;1-10(14)13-7-5-11(6-8-13)9-12(2,3)4;1-5-11(14)13-8-6-10(7-9-13)12(2,3)4;1-5-8-13-9-6-11(7-10-13)12(2,3)4;1-5-12-8-6-10(7-9-12)11(2,3)4/h11H,5-10H2,1-4H3;10H,6-9H2,1-5H3;11H,5-9H2,1-4H3;10H,5-9H2,1-4H3;11H,5-10H2,1-4H3;10H,5-9H2,1-4H3
InChIKeyFHPWLLQZLYBPIK-UHFFFAOYSA-N
MW1170.98 g/mol
LogP16.78
Rot. Bonds7

About 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one

4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one (PubChem CID 158034861) has the molecular formula C72H143N7O4 and a molecular weight of 1170.98 g/mol. Its IUPAC name is 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one
PubChem CID158034861
Molecular FormulaC72H143N7O4
Molecular Weight1170.98 g/mol
Exact Mass1170.12
IUPAC Name4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one
SMILESCC(=O)N1CCC(CC(C)(C)C)CC1.CCC(=O)N1CCC(C(C)(C)C)CC1.CCC(=O)N1CCC(CC(C)(C)C)CC1.CCCN1CCC(C(C)(C)C)CC1.CCN1CCC(C(C)(C)C)CC1.CN(C)C(=O)N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C13H25NO.C12H24N2O.2C12H23NO.C12H25N.C11H23N/c1-5-12(15)14-8-6-11(7-9-14)10-13(2,3)4;1-12(2,3)10-6-8-14(9-7-10)11(15)13(4)5;1-10(14)13-7-5-11(6-8-13)9-12(2,3)4;1-5-11(14)13-8-6-10(7-9-13)12(2,3)4;1-5-8-13-9-6-11(7-10-13)12(2,3)4;1-5-12-8-6-10(7-9-12)11(2,3)4/h11H,5-10H2,1-4H3;10H,6-9H2,1-5H3;11H,5-9H2,1-4H3;10H,5-9H2,1-4H3;11H,5-10H2,1-4H3;10H,5-9H2,1-4H3
InChIKeyFHPWLLQZLYBPIK-UHFFFAOYSA-N
XLogP16.78
TPSA90.96 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms83
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001170.98
LogP ≤ 516.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one with MolForge

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Related Compounds

(3R)-3-(2,2-dimethylpropyl)-N,N-dimethylpyrrolidine-1-carboxamide
CID 164775319
4-tert-butyl-N-[(1-ethylpiperidin-4-yl)methyl]piperidine-1-carboxamide
CID 118688704
1-(4-tert-butylpiperidin-1-yl)ethanone;ethane
CID 165078981
ethane;1-(4-propylpiperazin-1-yl)propan-1-one
CID 171788369
N,N-dimethyl-4-(trifluoromethyl)piperidine-1-carboxamide
CID 115661303
N,2,2-trimethyl-N-(1-propylpiperidin-4-yl)propanamide
CID 64590731
2-(1-dodecylpiperidin-4-yl)-N,N,2-trimethylpropanamide
CID 15294371
1-(4-tert-butylpiperidin-1-yl)-3-methylbutan-1-one
CID 70657702
1-[4-[(4-propylpiperazin-1-yl)methyl]piperazin-1-yl]propan-1-one
CID 178000242
bis(tert-butylcyclohexane);1-(4-tert-butylpiperidin-1-yl)ethanone;methane
CID 159596797
3-[(4-tert-butylpiperidine-1-carbonyl)-methylamino]-2-methylpropanoic acid
CID 62084014
1-[(3S)-3-(2-aminopropan-2-yl)pyrrolidin-1-yl]propan-1-one
CID 89224237

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one?
The IUPAC name of 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one (CID 158034861) is 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one is CC(=O)N1CCC(CC(C)(C)C)CC1.CCC(=O)N1CCC(C(C)(C)C)CC1.CCC(=O)N1CCC(CC(C)(C)C)CC1.CCCN1CCC(C(C)(C)C)CC1.CCN1CCC(C(C)(C)C)CC1.CN(C)C(=O)N1CCC(C(C)(C)C)CC1.
What is the InChIKey of 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one?
The InChIKey is FHPWLLQZLYBPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO.C12H24N2O.2C12H23NO.C12H25N.C11H23N/c1-5-12(15)14-8-6-11(7-9-14)10-13(2,3)4;1-12(2,3)10-6-8-14(9-7-10)11(15)13(4)5;1-10(14)13-7-5-11(6-8-13)9-12(2,3)4;1-5-11(14)13-8-6-10(7-9-13)12(2,3)4;1-5-8-13-9-6-11(7-10-13)12(2,3)4;1-5-12-8-6-10(7-9-12)11(2,3)4/h11H,5-10H2,1-4H3;10H,6-9H2,1-5H3;11H,5-9H2,1-4H3;10H,5-9H2,1-4H3;11H,5-10H2,1-4H3;10H,5-9H2,1-4H3.
What are the key properties of 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one?
4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one has a molecular weight of 1170.98 g/mol, XLogP of 16.78, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 158034861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).