N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide

C21H23N5O3 — CID 164879657

IUPACN-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide
SMILESCc1cc(CC(=O)Nc2cc([C@@H]3CC[C@H](NC(=O)c4ccccc4)C3)[nH]n2)on1
InChIInChI=1S/C21H23N5O3/c1-13-9-17(29-26-13)11-20(27)23-19-12-18(24-25-19)15-7-8-16(10-15)22-21(28)14-5-3-2-4-6-14/h2-6,9,12,15-16H,7-8,10-11H2,1H3,(H,22,28)(H2,23,24,25,27)/t15-,16+/m1/s1
InChIKeyIHMXWWVNQSGEJZ-CVEARBPZSA-N
MW393.45 g/mol
LogP2.95
Rot. Bonds6

About N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide

N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide (PubChem CID 164879657) has the molecular formula C21H23N5O3 and a molecular weight of 393.45 g/mol. Its IUPAC name is N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide.

Molecular Properties

Compound NameN-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide
PubChem CID164879657
Molecular FormulaC21H23N5O3
Molecular Weight393.45 g/mol
Exact Mass393.18
IUPAC NameN-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide
SMILESCc1cc(CC(=O)Nc2cc([C@@H]3CC[C@H](NC(=O)c4ccccc4)C3)[nH]n2)on1
InChIInChI=1S/C21H23N5O3/c1-13-9-17(29-26-13)11-20(27)23-19-12-18(24-25-19)15-7-8-16(10-15)22-21(28)14-5-3-2-4-6-14/h2-6,9,12,15-16H,7-8,10-11H2,1H3,(H,22,28)(H2,23,24,25,27)/t15-,16+/m1/s1
InChIKeyIHMXWWVNQSGEJZ-CVEARBPZSA-N
XLogP2.95
TPSA112.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.45
LogP ≤ 52.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide 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-[5-[(1S,3R)-3-[(1-methylcyclopropyl)carbamoylamino]cyclopentyl]-1H-pyrazol-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 164879508
N-[5-[3-(methylamino)cyclopentyl]-1H-pyrazol-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide;N-propan-2-ylformamide
CID 164879553
2-(3-methyl-1,2-oxazol-5-yl)-N-[5-[(1R,3S)-3-(2-propan-2-ylphenoxy)cyclopentyl]-1H-pyrazol-3-yl]acetamide
CID 171719126
[4-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclohexyl] carbamate
CID 175516829
[(1R,3S)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] (2S,3S)-2,3-dimethylazetidine-1-carboxylate
CID 170082112
[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] (2S)-2-amino-3-methylbutanoate
CID 164879612
N-[5-(3-benzamidocyclobutyl)-1H-pyrazol-3-yl]oxane-4-carboxamide
CID 90987494
N-[5-[3-(4,4-dimethyl-2-oxoimidazolidin-1-yl)cyclopentyl]-1H-pyrazol-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 170451268
[3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-(1-bicyclo[1.1.1]pentanyl)carbamate
CID 167143152
[(1R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] N-(1-bicyclo[1.1.1]pentanyl)carbamate
CID 167144088
[(1R,3S)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl] (2S)-2-methylpiperidine-1-carboxylate
CID 154616495
2-(3-methyl-1,2-oxazol-5-yl)-N-[5-[(1R,3R)-3-[2-oxo-2-(propan-2-ylamino)ethyl]-3-propan-2-ylcyclopentyl]-1H-pyrazol-3-yl]acetamide
CID 171719232

Frequently Asked Questions

What is the IUPAC name of N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide?
The IUPAC name of N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide (CID 164879657) is N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide.
What is the SMILES notation for N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide?
The canonical SMILES for N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide is Cc1cc(CC(=O)Nc2cc([C@@H]3CC[C@H](NC(=O)c4ccccc4)C3)[nH]n2)on1.
What is the InChIKey of N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide?
The InChIKey is IHMXWWVNQSGEJZ-CVEARBPZSA-N. The full InChI is InChI=1S/C21H23N5O3/c1-13-9-17(29-26-13)11-20(27)23-19-12-18(24-25-19)15-7-8-16(10-15)22-21(28)14-5-3-2-4-6-14/h2-6,9,12,15-16H,7-8,10-11H2,1H3,(H,22,28)(H2,23,24,25,27)/t15-,16+/m1/s1.
What are the key properties of N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide?
N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide has a molecular weight of 393.45 g/mol, XLogP of 2.95, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,3R)-3-[3-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]-1H-pyrazol-5-yl]cyclopentyl]benzamide is sourced from PubChem (CID 164879657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).