N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide

C23H19FN4O2 — CID 55798587

IUPACN-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESO=C(NC(COc1ccccc1F)c1ccccc1)c1ccc(-n2cccn2)nc1
InChIInChI=1S/C23H19FN4O2/c24-19-9-4-5-10-21(19)30-16-20(17-7-2-1-3-8-17)27-23(29)18-11-12-22(25-15-18)28-14-6-13-26-28/h1-15,20H,16H2,(H,27,29)
InChIKeyWTRVMAZHDDTXMI-UHFFFAOYSA-N
MW402.43 g/mol
LogP3.96
Rot. Bonds7

About N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide

N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide (PubChem CID 55798587) has the molecular formula C23H19FN4O2 and a molecular weight of 402.43 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide
PubChem CID55798587
Molecular FormulaC23H19FN4O2
Molecular Weight402.43 g/mol
Exact Mass402.15
IUPAC NameN-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESO=C(NC(COc1ccccc1F)c1ccccc1)c1ccc(-n2cccn2)nc1
InChIInChI=1S/C23H19FN4O2/c24-19-9-4-5-10-21(19)30-16-20(17-7-2-1-3-8-17)27-23(29)18-11-12-22(25-15-18)28-14-6-13-26-28/h1-15,20H,16H2,(H,27,29)
InChIKeyWTRVMAZHDDTXMI-UHFFFAOYSA-N
XLogP3.96
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.43
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 3-(4-methylphenyl)-3-[(6-pyrazol-1-ylpyridine-3-carbonyl)amino]propanoate
CID 55532033
N-[2-(2-fluorophenoxy)-1-phenylethyl]-1H-indazole-7-carboxamide
CID 55972822
N-[1-(2,4-difluorophenyl)ethyl]-6-pyrazol-1-ylpyridine-3-carboxamide
CID 42939102
N-[2-(2-fluorophenoxy)-1-phenylethyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 55799758
N-methyl-6-pyrazol-1-ylpyridine-3-carboxamide
CID 3758867
2-chloro-N-[2-(2-fluorophenoxy)-1-phenylethyl]acetamide
CID 146083123
N-[1-(3,4-diethoxyphenyl)ethyl]-6-pyrazol-1-ylpyridine-3-carboxamide
CID 55523156
N-(2,4-difluorophenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
CID 3567091
2-(cyclopropylmethylamino)-N-[2-(2-fluorophenoxy)-1-phenylethyl]acetamide
CID 119735715
N-[2-(2-fluorophenoxy)-1-phenylethyl]-3-(2-hydroxyphenyl)propanamide
CID 112835967
methyl N-[2-[[(1S)-2-(2-fluorophenoxy)-1-phenylethyl]amino]-2-oxoethyl]carbamate
CID 94612751
3-amino-N-[2-(2-fluorophenoxy)-1-phenylethyl]butanamide;hydrochloride
CID 119735720

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide (CID 55798587) is N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide is O=C(NC(COc1ccccc1F)c1ccccc1)c1ccc(-n2cccn2)nc1.
What is the InChIKey of N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
The InChIKey is WTRVMAZHDDTXMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4O2/c24-19-9-4-5-10-21(19)30-16-20(17-7-2-1-3-8-17)27-23(29)18-11-12-22(25-15-18)28-14-6-13-26-28/h1-15,20H,16H2,(H,27,29).
What are the key properties of N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide?
N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide has a molecular weight of 402.43 g/mol, XLogP of 3.96, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)-1-phenylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 55798587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).