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

C14H17N3O2 — CID 42949038

IUPACN-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide
SMILESCOc1ccc(C)cc1NC(=O)C(C)n1cccn1
InChIInChI=1S/C14H17N3O2/c1-10-5-6-13(19-3)12(9-10)16-14(18)11(2)17-8-4-7-15-17/h4-9,11H,1-3H3,(H,16,18)
InChIKeyQMEMHMAENSVIOI-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.40
Rot. Bonds4

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

N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide (PubChem CID 42949038) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide
PubChem CID42949038
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide
SMILESCOc1ccc(C)cc1NC(=O)C(C)n1cccn1
InChIInChI=1S/C14H17N3O2/c1-10-5-6-13(19-3)12(9-10)16-14(18)11(2)17-8-4-7-15-17/h4-9,11H,1-3H3,(H,16,18)
InChIKeyQMEMHMAENSVIOI-UHFFFAOYSA-N
XLogP2.40
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-(2-methoxy-5-methylphenyl)-2-(6-oxopyridazin-1-yl)propanamide
CID 51868313
N-(2-methoxy-5-methylphenyl)-2-(6-oxopyridazin-1-yl)propanamide
CID 45497099
N-(4-chloro-2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide
CID 42884870
N-[1-(2-methoxy-5-methylphenyl)ethyl]-2-pyrazol-1-ylpropanamide
CID 134048712
2-(4-bromo-3-methylpyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)propanamide
CID 19533348
N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
CID 134060372
(2S)-N-(2-methoxy-5-methylphenyl)-2-pyrrolidin-1-ylpropanamide
CID 9274960
methyl 4-methyl-3-(2-pyrazol-1-ylpropanoylamino)benzoate
CID 42887736
(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
CID 22690513
(2R)-2-acetamido-N-(2-methoxy-5-methylphenyl)-3-methylbutanamide
CID 40917712
(2R)-N-(2-methoxy-5-methylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide
CID 9445490
N-(2-methoxy-5-methylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 17447434

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide (CID 42949038) is N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide is COc1ccc(C)cc1NC(=O)C(C)n1cccn1.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide?
The InChIKey is QMEMHMAENSVIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-5-6-13(19-3)12(9-10)16-14(18)11(2)17-8-4-7-15-17/h4-9,11H,1-3H3,(H,16,18).
What are the key properties of N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide?
N-(2-methoxy-5-methylphenyl)-2-pyrazol-1-ylpropanamide has a molecular weight of 259.31 g/mol, XLogP of 2.40, 4 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)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 42949038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).