4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide

C23H35N3O2 — CID 113005494

IUPAC4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide
SMILESCC(C)N(Cc1ccccc1)C(=O)C1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C23H35N3O2/c1-18(2)26(17-19-9-5-3-6-10-19)22(27)20-13-15-25(16-14-20)23(28)24-21-11-7-4-8-12-21/h3,5-6,9-10,18,20-21H,4,7-8,11-17H2,1-2H3,(H,24,28)
InChIKeyQGFOGLXOIYZKPU-UHFFFAOYSA-N
MW385.55 g/mol
LogP4.18
Rot. Bonds5

About 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide

4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide (PubChem CID 113005494) has the molecular formula C23H35N3O2 and a molecular weight of 385.55 g/mol. Its IUPAC name is 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide
PubChem CID113005494
Molecular FormulaC23H35N3O2
Molecular Weight385.55 g/mol
Exact Mass385.27
IUPAC Name4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide
SMILESCC(C)N(Cc1ccccc1)C(=O)C1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C23H35N3O2/c1-18(2)26(17-19-9-5-3-6-10-19)22(27)20-13-15-25(16-14-20)23(28)24-21-11-7-4-8-12-21/h3,5-6,9-10,18,20-21H,4,7-8,11-17H2,1-2H3,(H,24,28)
InChIKeyQGFOGLXOIYZKPU-UHFFFAOYSA-N
XLogP4.18
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.55
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-1-methylsulfonyl-N-propan-2-ylpiperidine-4-carboxamide
CID 110700192
N-benzyl-1-[(E)-3-phenylprop-2-enoyl]-N-propan-2-ylpiperidine-4-carboxamide
CID 51323600
N-benzyl-N-propan-2-yl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 17224062
N-benzyl-1-(3-methylbenzoyl)-N-propan-2-ylpiperidine-4-carboxamide
CID 113005476
1-N'-benzyl-1-N-cyclohexyl-1-N'-propan-2-ylcyclopropane-1,1-dicarboxamide
CID 108972199
N-benzyl-4-(4-ethylpiperazine-1-carbonyl)-N-propan-2-ylcyclohexane-1-carboxamide
CID 109147520
N-benzyl-N-propan-2-yloxane-3-carboxamide
CID 110855554
4-N-benzyl-1-N-phenyl-4-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109149711
N-cyclohexyl-4-[1-(3-phenylpropanoyl)piperidine-4-carbonyl]piperazine-1-carboxamide
CID 55634615
N-benzyl-N-propan-2-yl-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131864
N-[(4-aminophenyl)methyl]-N-propan-2-ylcyclohexanecarboxamide
CID 43460030
2-[benzyl-(2-phenylsulfanylacetyl)amino]-N-cyclohexylpropanamide
CID 132984702

Frequently Asked Questions

What is the IUPAC name of 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide (CID 113005494) is 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide is CC(C)N(Cc1ccccc1)C(=O)C1CCN(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
The InChIKey is QGFOGLXOIYZKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O2/c1-18(2)26(17-19-9-5-3-6-10-19)22(27)20-13-15-25(16-14-20)23(28)24-21-11-7-4-8-12-21/h3,5-6,9-10,18,20-21H,4,7-8,11-17H2,1-2H3,(H,24,28).
What are the key properties of 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide?
4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide has a molecular weight of 385.55 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-benzyl-1-N-cyclohexyl-4-N-propan-2-ylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 113005494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).