(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

C17H15ClN4O2 — CID 39166910

IUPAC(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C17H15ClN4O2/c1-12(24-15-8-3-2-6-13(15)18)17(23)21-14-7-4-9-19-16(14)22-11-5-10-20-22/h2-12H,1H3,(H,21,23)/t12-/m1/s1
InChIKeyVAQUUTYUTYBUQQ-GFCCVEGCSA-N
MW342.79 g/mol
LogP3.33
Rot. Bonds5

About (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (PubChem CID 39166910) has the molecular formula C17H15ClN4O2 and a molecular weight of 342.79 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
PubChem CID39166910
Molecular FormulaC17H15ClN4O2
Molecular Weight342.79 g/mol
Exact Mass342.09
IUPAC Name(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C17H15ClN4O2/c1-12(24-15-8-3-2-6-13(15)18)17(23)21-14-7-4-9-19-16(14)22-11-5-10-20-22/h2-12H,1H3,(H,21,23)/t12-/m1/s1
InChIKeyVAQUUTYUTYBUQQ-GFCCVEGCSA-N
XLogP3.33
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.79
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(2-fluorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 39166908
2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 43063138
(2S)-2-amino-3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
CID 61180497
2-(2-chlorophenoxy)-N-(3-methoxy-2-pyridinyl)propanamide
CID 51107977
2-(2-chlorophenoxy)-N-[2-(1,2,4-triazol-1-ylmethyl)phenyl]propanamide
CID 55908667
(2S,3S)-2-amino-3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 61180684
2-amino-4-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714222
3-(2,3-dichlorophenyl)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 60553304
2-(2-chlorophenoxy)-N-(4-methyl-2-pyridinyl)propanamide
CID 46581275
(2S)-2-(2-chlorophenoxy)-N-(1H-1,2,4-triazol-5-yl)propanamide
CID 30863929
(2S)-2-(2-chlorophenoxy)-N-(2-ethylsulfanylphenyl)propanamide
CID 92675918
2-amino-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714225

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The IUPAC name of (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (CID 39166910) is (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.
What is the SMILES notation for (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The canonical SMILES for (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is C[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccnc1-n1cccn1.
What is the InChIKey of (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The InChIKey is VAQUUTYUTYBUQQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H15ClN4O2/c1-12(24-15-8-3-2-6-13(15)18)17(23)21-14-7-4-9-19-16(14)22-11-5-10-20-22/h2-12H,1H3,(H,21,23)/t12-/m1/s1.
What are the key properties of (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide has a molecular weight of 342.79 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 39166910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).