N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide

C18H20N2O2 — CID 135137576

IUPACN-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide
SMILESO=C(Nc1ccc(O)cn1)C1CCC(c2ccccc2)CC1
InChIInChI=1S/C18H20N2O2/c21-16-10-11-17(19-12-16)20-18(22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-5,10-12,14-15,21H,6-9H2,(H,19,20,22)
InChIKeyONASJFJQNQGCSW-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.70
Rot. Bonds3

About N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide

N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide (PubChem CID 135137576) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide
PubChem CID135137576
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide
SMILESO=C(Nc1ccc(O)cn1)C1CCC(c2ccccc2)CC1
InChIInChI=1S/C18H20N2O2/c21-16-10-11-17(19-12-16)20-18(22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-5,10-12,14-15,21H,6-9H2,(H,19,20,22)
InChIKeyONASJFJQNQGCSW-UHFFFAOYSA-N
XLogP3.70
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide?
The IUPAC name of N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide (CID 135137576) is N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide.
What is the SMILES notation for N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide?
The canonical SMILES for N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide is O=C(Nc1ccc(O)cn1)C1CCC(c2ccccc2)CC1.
What is the InChIKey of N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide?
The InChIKey is ONASJFJQNQGCSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c21-16-10-11-17(19-12-16)20-18(22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-5,10-12,14-15,21H,6-9H2,(H,19,20,22).
What are the key properties of N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide?
N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-2-pyridinyl)-4-phenylcyclohexane-1-carboxamide is sourced from PubChem (CID 135137576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).