N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide

C20H23N5O2 — CID 16672987

IUPACN-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
SMILESCOc1cccc(C2(NC(=O)c3cc(-c4cnn(C)c4)n[nH]3)CCCC2)c1
InChIInChI=1S/C20H23N5O2/c1-25-13-14(12-21-25)17-11-18(24-23-17)19(26)22-20(8-3-4-9-20)15-6-5-7-16(10-15)27-2/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,22,26)(H,23,24)
InChIKeyRMBUZYNPEVFPEI-UHFFFAOYSA-N
MW365.44 g/mol
LogP3.02
Rot. Bonds5

About N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide

N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide (PubChem CID 16672987) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
PubChem CID16672987
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC NameN-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
SMILESCOc1cccc(C2(NC(=O)c3cc(-c4cnn(C)c4)n[nH]3)CCCC2)c1
InChIInChI=1S/C20H23N5O2/c1-25-13-14(12-21-25)17-11-18(24-23-17)19(26)22-20(8-3-4-9-20)15-6-5-7-16(10-15)27-2/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,22,26)(H,23,24)
InChIKeyRMBUZYNPEVFPEI-UHFFFAOYSA-N
XLogP3.02
TPSA84.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-yl)-3-methoxybenzamide
CID 25206166
N-[(3-methoxyphenyl)methyl]-6-(1H-pyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridine-2-carboxamide
CID 57394348
Tetrahydro-benzodipyrazole deriv. 7j
CID 135403026
N-(3-methoxybenzyl)-5-(3-methoxyphenyl)-1H-pyrazole-3-carboxamide
CID 16022629
1H-Pyrazole-3-carboxylic acid [(1,1-dimethyl-propylcarbamoyl)-(3-methoxy-phenyl)-methyl]-(3-methoxy-phenyl)-amide
CID 650280
5-(3-methoxyphenyl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide
CID 3243257
N'-[(E)-(4-ethoxyphenyl)methylidene]-3-(1-methyl-1H-pyrrol-2-yl)-1H-pyrazole-5-carbohydrazide
CID 6869471
5-(1-Methyl-1H-pyrrol-2-yl)-2H-pyrazole-3-carboxylic acid (3-methoxy-benzylidene)-hydrazide
CID 9557099
3-(3-Methoxyphenyl)-5-propyl-4-(2-pyridyl)-4,5-dihydropyrrolo[3,4-C]pyrazol-6(1H)-one
CID 16014251
N-[(3-methoxyphenyl)methyl]-6-(5-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridine-2-carboxamide
CID 57403072
N-[2-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-1H-pyrazole-5-carboxamide
CID 166629984
3-(3-methoxyphenyl)-N-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 16022631

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide (CID 16672987) is N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide is COc1cccc(C2(NC(=O)c3cc(-c4cnn(C)c4)n[nH]3)CCCC2)c1.
What is the InChIKey of N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is RMBUZYNPEVFPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-25-13-14(12-21-25)17-11-18(24-23-17)19(26)22-20(8-3-4-9-20)15-6-5-7-16(10-15)27-2/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,22,26)(H,23,24).
What are the key properties of N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide?
N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methoxyphenyl)cyclopentyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 16672987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).