1-(2-tert-butylphenyl)piperidine-4-carboxamide

C16H24N2O — CID 117008321

IUPAC1-(2-tert-butylphenyl)piperidine-4-carboxamide
SMILESCC(C)(C)c1ccccc1N1CCC(C(N)=O)CC1
InChIInChI=1S/C16H24N2O/c1-16(2,3)13-6-4-5-7-14(13)18-10-8-12(9-11-18)15(17)19/h4-7,12H,8-11H2,1-3H3,(H2,17,19)
InChIKeyHNLHIRIVNOXZGV-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.69
Rot. Bonds2

About 1-(2-tert-butylphenyl)piperidine-4-carboxamide

1-(2-tert-butylphenyl)piperidine-4-carboxamide (PubChem CID 117008321) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(2-tert-butylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-tert-butylphenyl)piperidine-4-carboxamide
PubChem CID117008321
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-(2-tert-butylphenyl)piperidine-4-carboxamide
SMILESCC(C)(C)c1ccccc1N1CCC(C(N)=O)CC1
InChIInChI=1S/C16H24N2O/c1-16(2,3)13-6-4-5-7-14(13)18-10-8-12(9-11-18)15(17)19/h4-7,12H,8-11H2,1-3H3,(H2,17,19)
InChIKeyHNLHIRIVNOXZGV-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-tert-butylphenyl)piperidine-4-carboxamide (CID 117008321) is 1-(2-tert-butylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-tert-butylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-tert-butylphenyl)piperidine-4-carboxamide is CC(C)(C)c1ccccc1N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-(2-tert-butylphenyl)piperidine-4-carboxamide?
The InChIKey is HNLHIRIVNOXZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-16(2,3)13-6-4-5-7-14(13)18-10-8-12(9-11-18)15(17)19/h4-7,12H,8-11H2,1-3H3,(H2,17,19).
What are the key properties of 1-(2-tert-butylphenyl)piperidine-4-carboxamide?
1-(2-tert-butylphenyl)piperidine-4-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 117008321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).