N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide

C25H32N2O3 — CID 23072106

IUPACN-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide
SMILESCc1ccc(C2(O)CCN(C(=O)Nc3cccc(OC4CCCCC4)c3)CC2)cc1
InChIInChI=1S/C25H32N2O3/c1-19-10-12-20(13-11-19)25(29)14-16-27(17-15-25)24(28)26-21-6-5-9-23(18-21)30-22-7-3-2-4-8-22/h5-6,9-13,18,22,29H,2-4,7-8,14-17H2,1H3,(H,26,28)
InChIKeyHSASWMPLTLMLKV-UHFFFAOYSA-N
MW408.54 g/mol
LogP5.22
Rot. Bonds4

About N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide

N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide (PubChem CID 23072106) has the molecular formula C25H32N2O3 and a molecular weight of 408.54 g/mol. Its IUPAC name is N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide
PubChem CID23072106
Molecular FormulaC25H32N2O3
Molecular Weight408.54 g/mol
Exact Mass408.24
IUPAC NameN-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide
SMILESCc1ccc(C2(O)CCN(C(=O)Nc3cccc(OC4CCCCC4)c3)CC2)cc1
InChIInChI=1S/C25H32N2O3/c1-19-10-12-20(13-11-19)25(29)14-16-27(17-15-25)24(28)26-21-6-5-9-23(18-21)30-22-7-3-2-4-8-22/h5-6,9-13,18,22,29H,2-4,7-8,14-17H2,1H3,(H,26,28)
InChIKeyHSASWMPLTLMLKV-UHFFFAOYSA-N
XLogP5.22
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.54
LogP ≤ 55.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyclopentyloxyphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111424820
4-(tert-butylsulfonylamino)-N-(3-cyclohexyloxyphenyl)piperidine-1-carboxamide
CID 20629788
4-cyclopentyl-4-hydroxy-N-(3-methoxyphenyl)piperidine-1-carboxamide
CID 23071820
(9aS)-N-(3-cyclopentyloxyphenyl)-8-methyl-9-oxo-1,3,4,6,7,9a-hexahydropyrazino[1,2-a]pyrazine-2-carboxamide
CID 97276497
4-cyclohexyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide
CID 23071773
2-amino-N-(3-cyclopentyloxyphenyl)-2-(4-methylphenyl)acetamide
CID 120667187
2-amino-N-(3-cyclopentyloxyphenyl)propanamide
CID 82044663
N-(3-cyclopentyloxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119714958
4-cyclopropyl-4-hydroxy-N-(3-phenoxyphenyl)piperidine-1-carboxamide
CID 23071756
N-(3-cyclohexyloxyphenyl)-3-[4-[4-(trifluoromethoxy)phenyl]piperazin-1-yl]azetidine-1-carboxamide
CID 67082409
N-cyclohexyl-4-hydroxy-4-(4-methoxyphenyl)piperidine-1-carboxamide
CID 645525
N-(3-cyclopentyloxyphenyl)-5-methylfuran-2-carboxamide
CID 690631

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide (CID 23072106) is N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide is Cc1ccc(C2(O)CCN(C(=O)Nc3cccc(OC4CCCCC4)c3)CC2)cc1.
What is the InChIKey of N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide?
The InChIKey is HSASWMPLTLMLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N2O3/c1-19-10-12-20(13-11-19)25(29)14-16-27(17-15-25)24(28)26-21-6-5-9-23(18-21)30-22-7-3-2-4-8-22/h5-6,9-13,18,22,29H,2-4,7-8,14-17H2,1H3,(H,26,28).
What are the key properties of N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide?
N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide has a molecular weight of 408.54 g/mol, XLogP of 5.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyloxyphenyl)-4-hydroxy-4-(4-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 23072106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).