N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide

C15H18ClN3O2 — CID 42387509

IUPACN-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide
SMILESCC[C@@H](C)n1nccc1NC(=O)COc1cccc(Cl)c1
InChIInChI=1S/C15H18ClN3O2/c1-3-11(2)19-14(7-8-17-19)18-15(20)10-21-13-6-4-5-12(16)9-13/h4-9,11H,3,10H2,1-2H3,(H,18,20)/t11-/m1/s1
InChIKeyWZDAXBZUMITVLF-LLVKDONJSA-N
MW307.78 g/mol
LogP3.53
Rot. Bonds6

About N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide

N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide (PubChem CID 42387509) has the molecular formula C15H18ClN3O2 and a molecular weight of 307.78 g/mol. Its IUPAC name is N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide.

Molecular Properties

Compound NameN-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide
PubChem CID42387509
Molecular FormulaC15H18ClN3O2
Molecular Weight307.78 g/mol
Exact Mass307.11
IUPAC NameN-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide
SMILESCC[C@@H](C)n1nccc1NC(=O)COc1cccc(Cl)c1
InChIInChI=1S/C15H18ClN3O2/c1-3-11(2)19-14(7-8-17-19)18-15(20)10-21-13-6-4-5-12(16)9-13/h4-9,11H,3,10H2,1-2H3,(H,18,20)/t11-/m1/s1
InChIKeyWZDAXBZUMITVLF-LLVKDONJSA-N
XLogP3.53
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.78
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-butan-2-ylpyrazol-3-yl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 78778333
N-(2-butan-2-ylpyrazol-3-yl)-2-(4-methoxyphenoxy)acetamide
CID 43843335
2-(3,4-dichlorophenoxy)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 39063528
2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 35142597
N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-[3-(difluoromethoxy)phenyl]acetamide
CID 95615142
2-(3-chlorophenoxy)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 2241620
2-(4-phenoxyphenoxy)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 30187265
2-(3-chlorophenoxy)-N-ethoxyacetamide
CID 60700548
2-(2-ethoxyphenoxy)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 78772434
2-(3-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2632943
2-(4-chlorophenoxy)-N-[2-[(1S)-1-cyclopropylethyl]pyrazol-3-yl]acetamide
CID 29339507
N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-2-phenoxyacetamide
CID 60594497

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide?
The IUPAC name of N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide (CID 42387509) is N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide.
What is the SMILES notation for N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide?
The canonical SMILES for N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide is CC[C@@H](C)n1nccc1NC(=O)COc1cccc(Cl)c1.
What is the InChIKey of N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide?
The InChIKey is WZDAXBZUMITVLF-LLVKDONJSA-N. The full InChI is InChI=1S/C15H18ClN3O2/c1-3-11(2)19-14(7-8-17-19)18-15(20)10-21-13-6-4-5-12(16)9-13/h4-9,11H,3,10H2,1-2H3,(H,18,20)/t11-/m1/s1.
What are the key properties of N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide?
N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide has a molecular weight of 307.78 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide is sourced from PubChem (CID 42387509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).