1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide

C16H23N3O2 — CID 110676358

IUPAC1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide
SMILESCC(C)(NC(=O)N1CCC(C(N)=O)CC1)c1ccccc1
InChIInChI=1S/C16H23N3O2/c1-16(2,13-6-4-3-5-7-13)18-15(21)19-10-8-12(9-11-19)14(17)20/h3-7,12H,8-11H2,1-2H3,(H2,17,20)(H,18,21)
InChIKeyCTFYXZVFHWYIFN-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.83
Rot. Bonds3

About 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide

1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide (PubChem CID 110676358) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide
PubChem CID110676358
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide
SMILESCC(C)(NC(=O)N1CCC(C(N)=O)CC1)c1ccccc1
InChIInChI=1S/C16H23N3O2/c1-16(2,13-6-4-3-5-7-13)18-15(21)19-10-8-12(9-11-19)14(17)20/h3-7,12H,8-11H2,1-2H3,(H2,17,20)(H,18,21)
InChIKeyCTFYXZVFHWYIFN-UHFFFAOYSA-N
XLogP1.83
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-carbamoylpiperidine-1-carbonyl)amino]-2,2,3-trimethylbutanoic acid
CID 65266358
(3S)-1-N-[(2R)-3-methyl-3-phenylbutan-2-yl]pyrrolidine-1,3-dicarboxamide
CID 95310200
1-N-benzhydrylpiperidine-1,4-dicarboxamide
CID 108867553
1-(2-hydroxy-2-phenylpropyl)piperidine-4-carboxamide
CID 62373973
1-N-(4-phenylbutan-2-yl)piperidine-1,4-dicarboxamide
CID 51074335
N-[2-(4-chlorophenyl)propan-2-yl]azepane-1-carboxamide
CID 113216316
2-[(3-hydroxypyrrolidine-1-carbonyl)amino]-2-phenylpropanoic acid
CID 62942680
1-N-(1-phenylcyclopentyl)piperidine-1,4-dicarboxamide
CID 110676498
1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide
CID 71897846
1-(2-tert-butylphenyl)piperidine-4-carboxamide
CID 117008321
N-[2-(3,4-dimethoxyphenyl)propan-2-yl]pyrrolidine-1-carboxamide
CID 113216584
N-[2-(3,4-dimethoxyphenyl)propan-2-yl]-4-phenylpiperazine-1-carboxamide
CID 113216629

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide (CID 110676358) is 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide is CC(C)(NC(=O)N1CCC(C(N)=O)CC1)c1ccccc1.
What is the InChIKey of 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide?
The InChIKey is CTFYXZVFHWYIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-16(2,13-6-4-3-5-7-13)18-15(21)19-10-8-12(9-11-19)14(17)20/h3-7,12H,8-11H2,1-2H3,(H2,17,20)(H,18,21).
What are the key properties of 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide?
1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-phenylpropan-2-yl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 110676358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).