N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide

C17H30N2O2 — CID 113005394

IUPACN-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide
SMILESCC(C)(C)NC(=O)C1CCN(C(=O)C2CCCCC2)CC1
InChIInChI=1S/C17H30N2O2/c1-17(2,3)18-15(20)13-9-11-19(12-10-13)16(21)14-7-5-4-6-8-14/h13-14H,4-12H2,1-3H3,(H,18,20)
InChIKeyBSMMWYZVZBCFPH-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.72
Rot. Bonds2

About N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide

N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide (PubChem CID 113005394) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide
PubChem CID113005394
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC NameN-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide
SMILESCC(C)(C)NC(=O)C1CCN(C(=O)C2CCCCC2)CC1
InChIInChI=1S/C17H30N2O2/c1-17(2,3)18-15(20)13-9-11-19(12-10-13)16(21)14-7-5-4-6-8-14/h13-14H,4-12H2,1-3H3,(H,18,20)
InChIKeyBSMMWYZVZBCFPH-UHFFFAOYSA-N
XLogP2.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butylcyclooctanecarboxamide
CID 65022804
N-tert-butyl-4-(4-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146258
1-acetyl-N-tert-butylpiperidine-4-carboxamide
CID 17148671
1-tert-butyl-3-[1-(cyclohexanecarbonyl)piperidin-4-yl]urea
CID 110819716
[4-(azepane-1-carbonyl)piperidin-1-yl]-cyclopentylmethanone
CID 134029844
1-(cyclohexanecarbonyl)-N-cyclopentylpiperidine-4-carboxamide
CID 113002958
4-N-tert-butyl-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 60779224
4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide
CID 47238287
cyclohexyl(piperidin-1-yl)methanone
CID 12760854
aziridin-1-yl(cyclohexyl)methanone
CID 2309619
cycloheptyl(pyrrolidin-1-yl)methanone
CID 62778687
1-(cyclohexanecarbonyl)-N-(2-methylphenyl)piperidine-4-carboxamide
CID 113006064

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide?
The IUPAC name of N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide (CID 113005394) is N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide is CC(C)(C)NC(=O)C1CCN(C(=O)C2CCCCC2)CC1.
What is the InChIKey of N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide?
The InChIKey is BSMMWYZVZBCFPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-17(2,3)18-15(20)13-9-11-19(12-10-13)16(21)14-7-5-4-6-8-14/h13-14H,4-12H2,1-3H3,(H,18,20).
What are the key properties of N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide?
N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-(cyclohexanecarbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 113005394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).