2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide

C19H21FN2O — CID 159775749

IUPAC2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide
SMILESNC(=O)Cc1cc(C2CCCCC2c2ccc(F)cc2)ccn1
InChIInChI=1S/C19H21FN2O/c20-15-7-5-13(6-8-15)17-3-1-2-4-18(17)14-9-10-22-16(11-14)12-19(21)23/h5-11,17-18H,1-4,12H2,(H2,21,23)
InChIKeyNGSHBVMSMQZLMS-UHFFFAOYSA-N
MW312.39 g/mol
LogP3.69
Rot. Bonds4

About 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide

2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide (PubChem CID 159775749) has the molecular formula C19H21FN2O and a molecular weight of 312.39 g/mol. Its IUPAC name is 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide
PubChem CID159775749
Molecular FormulaC19H21FN2O
Molecular Weight312.39 g/mol
Exact Mass312.16
IUPAC Name2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide
SMILESNC(=O)Cc1cc(C2CCCCC2c2ccc(F)cc2)ccn1
InChIInChI=1S/C19H21FN2O/c20-15-7-5-13(6-8-15)17-3-1-2-4-18(17)14-9-10-22-16(11-14)12-19(21)23/h5-11,17-18H,1-4,12H2,(H2,21,23)
InChIKeyNGSHBVMSMQZLMS-UHFFFAOYSA-N
XLogP3.69
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide?
The IUPAC name of 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide (CID 159775749) is 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide.
What is the SMILES notation for 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide?
The canonical SMILES for 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide is NC(=O)Cc1cc(C2CCCCC2c2ccc(F)cc2)ccn1.
What is the InChIKey of 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide?
The InChIKey is NGSHBVMSMQZLMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O/c20-15-7-5-13(6-8-15)17-3-1-2-4-18(17)14-9-10-22-16(11-14)12-19(21)23/h5-11,17-18H,1-4,12H2,(H2,21,23).
What are the key properties of 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide?
2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide has a molecular weight of 312.39 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(4-fluorophenyl)cyclohexyl]-2-pyridinyl]acetamide is sourced from PubChem (CID 159775749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).