N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide

C17H21N3O3 — CID 51099252

IUPACN-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide
SMILESCOc1ccccc1-c1cc(NC(=O)CCC2CCCO2)n[nH]1
InChIInChI=1S/C17H21N3O3/c1-22-15-7-3-2-6-13(15)14-11-16(20-19-14)18-17(21)9-8-12-5-4-10-23-12/h2-3,6-7,11-12H,4-5,8-10H2,1H3,(H2,18,19,20,21)
InChIKeyYQSXKGZXXJEBJU-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.98
Rot. Bonds6

About N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide

N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide (PubChem CID 51099252) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide.

Molecular Properties

Compound NameN-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide
PubChem CID51099252
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC NameN-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide
SMILESCOc1ccccc1-c1cc(NC(=O)CCC2CCCO2)n[nH]1
InChIInChI=1S/C17H21N3O3/c1-22-15-7-3-2-6-13(15)14-11-16(20-19-14)18-17(21)9-8-12-5-4-10-23-12/h2-3,6-7,11-12H,4-5,8-10H2,1H3,(H2,18,19,20,21)
InChIKeyYQSXKGZXXJEBJU-UHFFFAOYSA-N
XLogP2.98
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-cyclopropyl-1H-pyrazol-3-yl)-4-methoxybenzamide
CID 5330975
N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-methoxybenzamide
CID 5330980
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
CID 5331000
N-(3-Cyclopropyl-1h-Pyrazol-5-Yl)-2-[4-(2-Pyrrolidin-1-Ylethoxy)phenyl]acetamide
CID 5331001
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 5331002
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-methoxybenzamide
CID 5330984
4-methoxy-N-(3-phenyl-1H-pyrazol-5-yl)benzamide
CID 819077
Indan-2-carboxylic acid [5-(4-methoxy-phenyl)-1H-pyrazol-3-yl]-amide
CID 10892960
Indan-2-carboxylic acid [5-(4-isopropoxy-phenyl)-1H-pyrazol-3-yl]-amide
CID 11057532
Way-361789
CID 24860582
N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-5-morpholin-4-ylpentanamide
CID 24998360
N-[5-(4-Methoxy-phenyl)-2H-pyrazol-3-yl]-4-piperidin-1-yl-butyramide
CID 25029711

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide?
The IUPAC name of N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide (CID 51099252) is N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide.
What is the SMILES notation for N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide?
The canonical SMILES for N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide is COc1ccccc1-c1cc(NC(=O)CCC2CCCO2)n[nH]1.
What is the InChIKey of N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide?
The InChIKey is YQSXKGZXXJEBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-22-15-7-3-2-6-13(15)14-11-16(20-19-14)18-17(21)9-8-12-5-4-10-23-12/h2-3,6-7,11-12H,4-5,8-10H2,1H3,(H2,18,19,20,21).
What are the key properties of N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide?
N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide has a molecular weight of 315.37 g/mol, XLogP of 2.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-(oxolan-2-yl)propanamide is sourced from PubChem (CID 51099252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).