N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide

C26H30N4O4 — CID 42765045

IUPACN-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide
SMILESCOc1ccc(-n2nc(C)c(-c3ccccc3)c2NC(=O)CCCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C26H30N4O4/c1-19-25(20-7-4-3-5-8-20)26(30(28-19)21-11-13-22(33-2)14-12-21)27-23(31)9-6-10-24(32)29-15-17-34-18-16-29/h3-5,7-8,11-14H,6,9-10,15-18H2,1-2H3,(H,27,31)
InChIKeyPRNJJZPKBIEGPS-UHFFFAOYSA-N
MW462.55 g/mol
LogP3.82
Rot. Bonds8

About N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide

N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide (PubChem CID 42765045) has the molecular formula C26H30N4O4 and a molecular weight of 462.55 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide
PubChem CID42765045
Molecular FormulaC26H30N4O4
Molecular Weight462.55 g/mol
Exact Mass462.23
IUPAC NameN-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide
SMILESCOc1ccc(-n2nc(C)c(-c3ccccc3)c2NC(=O)CCCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C26H30N4O4/c1-19-25(20-7-4-3-5-8-20)26(30(28-19)21-11-13-22(33-2)14-12-21)27-23(31)9-6-10-24(32)29-15-17-34-18-16-29/h3-5,7-8,11-14H,6,9-10,15-18H2,1-2H3,(H,27,31)
InChIKeyPRNJJZPKBIEGPS-UHFFFAOYSA-N
XLogP3.82
TPSA85.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.55
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2,6-dimethylmorpholin-4-yl)-N-(3-methyl-1,4-diphenylpyrazol-5-yl)-5-oxopentanamide
CID 5002174
5-[[1-(4-chlorophenyl)-3-methyl-4-phenylpyrazol-5-yl]amino]-5-oxopentanoate
CID 7207474
N-[2-[[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]amino]-2-oxoethyl]-2-methyl-N-(2-methylpropyl)propanamide
CID 42734974
N-[2-[[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]amino]-2-oxoethyl]-2-phenyl-N-propan-2-ylacetamide
CID 1056466
2-[(4-methoxyphenyl)carbamoyl-propylamino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]acetamide
CID 3898476
N-[2-[[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]amino]-2-oxoethyl]-N-propylcyclopentanecarboxamide
CID 1056480
N-[1-(3-fluorophenyl)-3-methyl-4-phenylpyrazol-5-yl]-4-oxo-4-piperidin-1-ylbutanamide
CID 3538346
2-[butyl-[(4-methoxyphenyl)carbamoyl]amino]-N-[3-methyl-1-(4-methylphenyl)-4-phenylpyrazol-5-yl]acetamide
CID 4648243
N-[1-(3-chlorophenyl)-3-methyl-4-phenylpyrazol-5-yl]-4-(4-ethylpiperazin-1-yl)-4-oxobutanamide
CID 4679445
N-[2-[[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]amino]-2-oxoethyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 1056457
ethyl 2-[[[2-[[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]amino]-2-oxoethyl]-(2-methylpropyl)carbamoyl]amino]acetate
CID 4253936
2-[(2-bromophenyl)carbamoyl-butylamino]-N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]acetamide
CID 3925296

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide?
The IUPAC name of N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide (CID 42765045) is N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide is COc1ccc(-n2nc(C)c(-c3ccccc3)c2NC(=O)CCCC(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide?
The InChIKey is PRNJJZPKBIEGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4O4/c1-19-25(20-7-4-3-5-8-20)26(30(28-19)21-11-13-22(33-2)14-12-21)27-23(31)9-6-10-24(32)29-15-17-34-18-16-29/h3-5,7-8,11-14H,6,9-10,15-18H2,1-2H3,(H,27,31).
What are the key properties of N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide?
N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide has a molecular weight of 462.55 g/mol, XLogP of 3.82, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)-3-methyl-4-phenylpyrazol-5-yl]-5-morpholin-4-yl-5-oxopentanamide is sourced from PubChem (CID 42765045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).