N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide

C22H22N2O2 — CID 66497312

IUPACN-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O
InChIInChI=1S/C22H22N2O2/c25-21(23-18-8-2-1-3-9-18)19-12-13-20(24-22(19)26)17-11-10-15-6-4-5-7-16(15)14-17/h4-7,10-14,18H,1-3,8-9H2,(H,23,25)(H,24,26)
InChIKeyFXXHRDCATRQGKJ-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.26
Rot. Bonds3

About N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide

N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 66497312) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID66497312
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O
InChIInChI=1S/C22H22N2O2/c25-21(23-18-8-2-1-3-9-18)19-12-13-20(24-22(19)26)17-11-10-15-6-4-5-7-16(15)14-17/h4-7,10-14,18H,1-3,8-9H2,(H,23,25)(H,24,26)
InChIKeyFXXHRDCATRQGKJ-UHFFFAOYSA-N
XLogP4.26
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide (CID 66497312) is N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide is O=C(NC1CCCCC1)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O.
What is the InChIKey of N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is FXXHRDCATRQGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c25-21(23-18-8-2-1-3-9-18)19-12-13-20(24-22(19)26)17-11-10-15-6-4-5-7-16(15)14-17/h4-7,10-14,18H,1-3,8-9H2,(H,23,25)(H,24,26).
What are the key properties of N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide?
N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 4.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 66497312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).