N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide

C26H20N4O2 — CID 23649066

IUPACN-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide
SMILESCn1cc(-c2cc(Oc3cccc(NC(=O)c4cccc5ccccc45)c3)ccn2)cn1
InChIInChI=1S/C26H20N4O2/c1-30-17-19(16-28-30)25-15-22(12-13-27-25)32-21-9-5-8-20(14-21)29-26(31)24-11-4-7-18-6-2-3-10-23(18)24/h2-17H,1H3,(H,29,31)
InChIKeyXRSBISJFAAHJPR-UHFFFAOYSA-N
MW420.47 g/mol
LogP5.68
Rot. Bonds5

About N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide

N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide (PubChem CID 23649066) has the molecular formula C26H20N4O2 and a molecular weight of 420.47 g/mol. Its IUPAC name is N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide
PubChem CID23649066
Molecular FormulaC26H20N4O2
Molecular Weight420.47 g/mol
Exact Mass420.16
IUPAC NameN-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide
SMILESCn1cc(-c2cc(Oc3cccc(NC(=O)c4cccc5ccccc45)c3)ccn2)cn1
InChIInChI=1S/C26H20N4O2/c1-30-17-19(16-28-30)25-15-22(12-13-27-25)32-21-9-5-8-20(14-21)29-26(31)24-11-4-7-18-6-2-3-10-23(18)24/h2-17H,1H3,(H,29,31)
InChIKeyXRSBISJFAAHJPR-UHFFFAOYSA-N
XLogP5.68
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.47
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]-1H-indole-7-carboxamide
CID 23649174
2-imidazol-1-yl-N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]benzamide;3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]aniline
CID 158680667
4-chloro-N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]-3-(trifluoromethyl)benzamide
CID 23649362
N-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]acetamide
CID 90403222
N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]benzamide
CID 171635424
1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
CID 166780718
2-cyclopropyl-1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
CID 166780701
6-amino-1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxopyridine-3-carboxamide
CID 159854481
1-[3-fluoro-4-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]-3-[3-(4-methylimidazol-1-yl)phenyl]urea
CID 66728742
2,2-dimethyl-N-[[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]propanamide
CID 86268065
6-[2-(methoxymethyl)pyrimidin-4-yl]oxy-N-(3-phenoxyphenyl)naphthalene-1-carboxamide
CID 23652869
2-methyl-3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]pyridine
CID 141415020

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide (CID 23649066) is N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide is Cn1cc(-c2cc(Oc3cccc(NC(=O)c4cccc5ccccc45)c3)ccn2)cn1.
What is the InChIKey of N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide?
The InChIKey is XRSBISJFAAHJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N4O2/c1-30-17-19(16-28-30)25-15-22(12-13-27-25)32-21-9-5-8-20(14-21)29-26(31)24-11-4-7-18-6-2-3-10-23(18)24/h2-17H,1H3,(H,29,31).
What are the key properties of N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide?
N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide has a molecular weight of 420.47 g/mol, XLogP of 5.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 23649066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).