N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide

C14H17N3O2 — CID 46339335

IUPACN-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide
SMILESCOc1ccc(C)cc1NC(=O)CCn1cccn1
InChIInChI=1S/C14H17N3O2/c1-11-4-5-13(19-2)12(10-11)16-14(18)6-9-17-8-3-7-15-17/h3-5,7-8,10H,6,9H2,1-2H3,(H,16,18)
InChIKeyRKIHZDGPMUZONH-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.23
Rot. Bonds5

About N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide

N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide (PubChem CID 46339335) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide
PubChem CID46339335
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide
SMILESCOc1ccc(C)cc1NC(=O)CCn1cccn1
InChIInChI=1S/C14H17N3O2/c1-11-4-5-13(19-2)12(10-11)16-14(18)6-9-17-8-3-7-15-17/h3-5,7-8,10H,6,9H2,1-2H3,(H,16,18)
InChIKeyRKIHZDGPMUZONH-UHFFFAOYSA-N
XLogP2.23
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-2-methoxyphenyl)-3-pyrazol-1-ylpropanamide
CID 47354774
N-(2-bromo-5-methylphenyl)-3-pyrazol-1-ylpropanamide
CID 82757585
N,N'-bis(2-methoxy-5-methylphenyl)pentanediamide
CID 5142107
N-(2-methoxy-5-methylphenyl)-3-(3-methyl-4-nitropyrazol-1-yl)propanamide
CID 19539774
N-(2-methoxy-5-methylphenyl)-4-oxopentanamide
CID 60636995
N-(2-methoxy-5-methylphenyl)dodecanamide
CID 4196048
N-(2-methoxy-5-methylphenyl)-3-piperazin-1-ylpropanamide
CID 28807979
N-(2-methoxy-5-methylphenyl)-3-(5-methyl-1,3-dioxoisoindol-2-yl)propanamide
CID 30430739
2-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl-N-(2-methoxy-5-methylphenyl)acetamide
CID 1447930
N-(5-amino-2-methoxyphenyl)-3-(4-methylpyrazol-1-yl)propanamide
CID 60874213
3-(2,6-dimethylmorpholin-4-yl)-N-(2-methoxy-5-methylphenyl)propanamide chloride
CID 53350774
N-(2-methoxy-5-methylphenyl)-3-(1,3-oxazol-4-yl)propanamide
CID 110679084

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide (CID 46339335) is N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide is COc1ccc(C)cc1NC(=O)CCn1cccn1.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide?
The InChIKey is RKIHZDGPMUZONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-11-4-5-13(19-2)12(10-11)16-14(18)6-9-17-8-3-7-15-17/h3-5,7-8,10H,6,9H2,1-2H3,(H,16,18).
What are the key properties of N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide?
N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide has a molecular weight of 259.31 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 46339335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).