N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide

C25H38N2O2 — CID 10739662

IUPACN-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCN(CC2CCCCC2)CC1)C(O)(c1ccccc1)C1CCCC1
InChIInChI=1S/C25H38N2O2/c28-24(25(29,22-13-7-8-14-22)21-11-5-2-6-12-21)26-23-15-17-27(18-16-23)19-20-9-3-1-4-10-20/h2,5-6,11-12,20,22-23,29H,1,3-4,7-10,13-19H2,(H,26,28)
InChIKeyOSKBHMKTWRTXFP-UHFFFAOYSA-N
MW398.59 g/mol
LogP4.23
Rot. Bonds6

About N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide

N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide (PubChem CID 10739662) has the molecular formula C25H38N2O2 and a molecular weight of 398.59 g/mol. Its IUPAC name is N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound NameN-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide
PubChem CID10739662
Molecular FormulaC25H38N2O2
Molecular Weight398.59 g/mol
Exact Mass398.29
IUPAC NameN-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCN(CC2CCCCC2)CC1)C(O)(c1ccccc1)C1CCCC1
InChIInChI=1S/C25H38N2O2/c28-24(25(29,22-13-7-8-14-22)21-11-5-2-6-12-21)26-23-15-17-27(18-16-23)19-20-9-3-1-4-10-20/h2,5-6,11-12,20,22-23,29H,1,3-4,7-10,13-19H2,(H,26,28)
InChIKeyOSKBHMKTWRTXFP-UHFFFAOYSA-N
XLogP4.23
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.59
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide?
The IUPAC name of N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide (CID 10739662) is N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide?
The canonical SMILES for N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide is O=C(NC1CCN(CC2CCCCC2)CC1)C(O)(c1ccccc1)C1CCCC1.
What is the InChIKey of N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide?
The InChIKey is OSKBHMKTWRTXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H38N2O2/c28-24(25(29,22-13-7-8-14-22)21-11-5-2-6-12-21)26-23-15-17-27(18-16-23)19-20-9-3-1-4-10-20/h2,5-6,11-12,20,22-23,29H,1,3-4,7-10,13-19H2,(H,26,28).
What are the key properties of N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide?
N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide has a molecular weight of 398.59 g/mol, XLogP of 4.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 10739662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).