1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide

C23H28N2O3 — CID 113008208

IUPAC1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
SMILESCC(C)C(=O)N1CCC(C(=O)Nc2ccc(OCc3ccccc3)cc2)CC1
InChIInChI=1S/C23H28N2O3/c1-17(2)23(27)25-14-12-19(13-15-25)22(26)24-20-8-10-21(11-9-20)28-16-18-6-4-3-5-7-18/h3-11,17,19H,12-16H2,1-2H3,(H,24,26)
InChIKeyFKMVGJAGYAKFIJ-UHFFFAOYSA-N
MW380.49 g/mol
LogP4.10
Rot. Bonds6

About 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide

1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide (PubChem CID 113008208) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
PubChem CID113008208
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
SMILESCC(C)C(=O)N1CCC(C(=O)Nc2ccc(OCc3ccccc3)cc2)CC1
InChIInChI=1S/C23H28N2O3/c1-17(2)23(27)25-14-12-19(13-15-25)22(26)24-20-8-10-21(11-9-20)28-16-18-6-4-3-5-7-18/h3-11,17,19H,12-16H2,1-2H3,(H,24,26)
InChIKeyFKMVGJAGYAKFIJ-UHFFFAOYSA-N
XLogP4.10
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-tert-butylbenzoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 1003986
1-methylsulfonyl-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 1082619
N-[4-(4-phenylmethoxyanilino)phenyl]cyclopropanecarboxamide
CID 112988911
1-[(2-chlorophenyl)methyl]-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 45014267
1-(dimethylsulfamoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 41454969
N-(4-acetamidophenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 31669191
3-[4-[[1-(2-methylpropanoyl)piperidine-4-carbonyl]amino]phenyl]propanoic acid
CID 119252463
1-[(2S)-2-(hexanoylamino)-2-(4-phenylmethoxyphenyl)acetyl]-N-phenylpiperidine-4-carboxamide
CID 164627679
1-(2-methylpropanoyl)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]piperidine-4-carboxamide
CID 131904149
1-(6-methylpyridazin-3-yl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 121119048
benzyl 4-[(4-methoxyphenyl)carbamoyl]piperidine-1-carboxylate
CID 75365770
4-N-(4-phenylmethoxyphenyl)-1-N-propylcyclohexane-1,4-dicarboxamide
CID 109144415

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide (CID 113008208) is 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide is CC(C)C(=O)N1CCC(C(=O)Nc2ccc(OCc3ccccc3)cc2)CC1.
What is the InChIKey of 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide?
The InChIKey is FKMVGJAGYAKFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-17(2)23(27)25-14-12-19(13-15-25)22(26)24-20-8-10-21(11-9-20)28-16-18-6-4-3-5-7-18/h3-11,17,19H,12-16H2,1-2H3,(H,24,26).
What are the key properties of 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide?
1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 4.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropanoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 113008208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).