N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide

C22H23N3O2 — CID 75467449

IUPACN-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)Nc2c(C)c(C3CC3)nn2-c2ccccc2)c1
InChIInChI=1S/C22H23N3O2/c1-15-20(17-11-12-17)24-25(19-9-4-3-5-10-19)21(15)23-22(26)18-8-6-7-16(13-18)14-27-2/h3-10,13,17H,11-12,14H2,1-2H3,(H,23,26)
InChIKeyWJZQMIVJDLFWDP-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.46
Rot. Bonds6

About N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide

N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide (PubChem CID 75467449) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide
PubChem CID75467449
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)Nc2c(C)c(C3CC3)nn2-c2ccccc2)c1
InChIInChI=1S/C22H23N3O2/c1-15-20(17-11-12-17)24-25(19-9-4-3-5-10-19)21(15)23-22(26)18-8-6-7-16(13-18)14-27-2/h3-10,13,17H,11-12,14H2,1-2H3,(H,23,26)
InChIKeyWJZQMIVJDLFWDP-UHFFFAOYSA-N
XLogP4.46
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-methyl-1,2-oxazole-5-carboxamide
CID 56786256
N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-2-fluoro-4,5-dimethoxybenzamide
CID 75468818
N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-2-(4-methoxyphenyl)-2-oxoacetamide
CID 75467763
4-[[(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)amino]methyl]benzamide
CID 71845529
trans-(1S,2S)-N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 97315585
carbonyl difluoride;1-[[3-(methoxymethyl)phenyl]methyl]-3-[4-methyl-1-phenyl-3-(piperidin-4-ylmethoxy)pyrazol-5-yl]urea
CID 160659974
3-(methoxymethyl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide;hydrochloride
CID 120643387
5-[[3-(methoxymethyl)benzoyl]amino]-3-methylthiophene-2-carboxylic acid
CID 43171275
3-(methoxymethyl)-N-(3-methoxy-6-methyl-2-pyridinyl)benzamide
CID 71982976
methyl 3-cyclopropyl-6-methyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxylate
CID 19588745
2-cyclopropyl-2-[[3-(methoxymethyl)benzoyl]amino]acetic acid
CID 62697280
N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-(methoxymethyl)benzamide
CID 24548704

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide?
The IUPAC name of N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide (CID 75467449) is N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide?
The canonical SMILES for N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide is COCc1cccc(C(=O)Nc2c(C)c(C3CC3)nn2-c2ccccc2)c1.
What is the InChIKey of N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide?
The InChIKey is WJZQMIVJDLFWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-15-20(17-11-12-17)24-25(19-9-4-3-5-10-19)21(15)23-22(26)18-8-6-7-16(13-18)14-27-2/h3-10,13,17H,11-12,14H2,1-2H3,(H,23,26).
What are the key properties of N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide?
N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide has a molecular weight of 361.45 g/mol, XLogP of 4.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-(methoxymethyl)benzamide is sourced from PubChem (CID 75467449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).