1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide

C18H28N2O — CID 141383860

IUPAC1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide
SMILESCC(C)(C)CNC(=O)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C18H28N2O/c1-18(2,3)14-19-17(21)16-9-11-20(12-10-16)13-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3,(H,19,21)
InChIKeyLEHMCVLCILHCEA-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.06
Rot. Bonds4

About 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide

1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide (PubChem CID 141383860) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide
PubChem CID141383860
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide
SMILESCC(C)(C)CNC(=O)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C18H28N2O/c1-18(2,3)14-19-17(21)16-9-11-20(12-10-16)13-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3,(H,19,21)
InChIKeyLEHMCVLCILHCEA-UHFFFAOYSA-N
XLogP3.06
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(1-benzylpiperidine-4-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 119250204
1-benzyl-N-pentylpiperidine-4-carboxamide
CID 45011479
1-benzyl-N-prop-2-enylpiperidine-4-carboxamide
CID 25246491
1-benzyl-N-(3-phenylpropyl)piperidine-4-carboxamide
CID 46773938
1-[(4-chlorophenyl)methyl]-N-[3-(dimethylamino)-2,2-dimethylpropyl]piperidine-4-carboxamide
CID 3920070
1-benzyl-N-[2-(methylamino)propyl]piperidine-4-carboxamide;dihydrochloride
CID 120831634
1-(1-benzylpiperidin-4-yl)ethanone
CID 910923
N-(1-amino-1-oxo-2-phenylpropan-2-yl)-1-benzylpiperidine-4-carboxamide
CID 136580049
1-benzyl-N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]piperidine-4-carboxamide
CID 136512544
3-[(1-benzylpiperidine-4-carbonyl)amino]-2-phenylpropanoic acid
CID 119254948
1-[(1-benzylpiperidine-4-carbonyl)amino]-3-ethylthiourea
CID 3806020
methyl 4-[[4-(benzylcarbamoyl)piperidin-1-yl]methyl]benzoate
CID 27107110

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide?
The IUPAC name of 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide (CID 141383860) is 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide?
The canonical SMILES for 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide is CC(C)(C)CNC(=O)C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide?
The InChIKey is LEHMCVLCILHCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-18(2,3)14-19-17(21)16-9-11-20(12-10-16)13-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3,(H,19,21).
What are the key properties of 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide?
1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide has a molecular weight of 288.44 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(2,2-dimethylpropyl)piperidine-4-carboxamide is sourced from PubChem (CID 141383860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).