6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide

C22H26N2O2 — CID 146325556

IUPAC6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide
SMILESCC1(c2ccc(Oc3ccc(C(N)=O)cn3)cc2)C2CCCC1CCC2
InChIInChI=1S/C22H26N2O2/c1-22(16-4-2-5-17(22)7-3-6-16)18-9-11-19(12-10-18)26-20-13-8-15(14-24-20)21(23)25/h8-14,16-17H,2-7H2,1H3,(H2,23,25)
InChIKeyNSZFODAUWUNOHH-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.83
Rot. Bonds4

About 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide

6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide (PubChem CID 146325556) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide
PubChem CID146325556
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide
SMILESCC1(c2ccc(Oc3ccc(C(N)=O)cn3)cc2)C2CCCC1CCC2
InChIInChI=1S/C22H26N2O2/c1-22(16-4-2-5-17(22)7-3-6-16)18-9-11-19(12-10-18)26-20-13-8-15(14-24-20)21(23)25/h8-14,16-17H,2-7H2,1H3,(H2,23,25)
InChIKeyNSZFODAUWUNOHH-UHFFFAOYSA-N
XLogP4.83
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide with MolForge

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Related Compounds

6-(4-hydroxyphenoxy)pyridine-3-carboxamide
CID 60868756
6-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91553748
methyl 4-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]benzoate
CID 146325637
6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 91471625
6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
CID 22087205
6-[4-[2-[(2-hydroxycyclopentyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68750412
6-[4-(1-aminopropyl)phenoxy]pyridine-3-carboxamide
CID 174444828
6-[4-[cyclohexyl(piperidin-1-yl)methyl]phenoxy]pyridine-3-carboxamide
CID 90911796
6-[[5-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]pyridine-3-carboxamide
CID 59750665
6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415252
6-[4-[(2R)-2-aminopropyl]phenoxy]pyridine-3-carboxamide;hydrochloride
CID 22087128
6-[4-[[(2S)-3,3-dimethyl-2-phenylazetidin-1-yl]methyl]phenoxy]pyridine-3-carboxamide
CID 56849551

Frequently Asked Questions

What is the IUPAC name of 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide?
The IUPAC name of 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide (CID 146325556) is 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide is CC1(c2ccc(Oc3ccc(C(N)=O)cn3)cc2)C2CCCC1CCC2.
What is the InChIKey of 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide?
The InChIKey is NSZFODAUWUNOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-22(16-4-2-5-17(22)7-3-6-16)18-9-11-19(12-10-18)26-20-13-8-15(14-24-20)21(23)25/h8-14,16-17H,2-7H2,1H3,(H2,23,25).
What are the key properties of 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide?
6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 146325556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).