[4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea

C15H19N5O — CID 123257754

IUPAC[4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea
SMILESCc1c([C@H]2CCCN2)nn(-c2ccccc2)c1NC(N)=O
InChIInChI=1S/C15H19N5O/c1-10-13(12-8-5-9-17-12)19-20(14(10)18-15(16)21)11-6-3-2-4-7-11/h2-4,6-7,12,17H,5,8-9H2,1H3,(H3,16,18,21)/t12-/m1/s1
InChIKeyOKNOQFRKWSWLDS-GFCCVEGCSA-N
MW285.35 g/mol
LogP2.10
Rot. Bonds3

About [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea

[4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea (PubChem CID 123257754) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea.

Molecular Properties

Compound Name[4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea
PubChem CID123257754
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name[4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea
SMILESCc1c([C@H]2CCCN2)nn(-c2ccccc2)c1NC(N)=O
InChIInChI=1S/C15H19N5O/c1-10-13(12-8-5-9-17-12)19-20(14(10)18-15(16)21)11-6-3-2-4-7-11/h2-4,6-7,12,17H,5,8-9H2,1H3,(H3,16,18,21)/t12-/m1/s1
InChIKeyOKNOQFRKWSWLDS-GFCCVEGCSA-N
XLogP2.10
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119697911
[3-[(2S)-2-hydroxypropoxy]-4-methyl-1-phenylpyrazol-5-yl]urea
CID 71041411
4-[[(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)amino]methyl]benzamide
CID 71845529
N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-3-methyl-1,2-oxazole-5-carboxamide
CID 56786256
[3-(2-methoxypyrimidin-5-yl)-4-methyl-1-phenylpyrazol-5-yl]urea
CID 139318982
N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-2-(4-methoxyphenyl)-2-oxoacetamide
CID 75467763
N,6-dicyclopropyl-1-phenyl-3-pyrrolidin-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134790258
2-(5-methyl-1-phenyltriazol-4-yl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 119512728
4-oxo-3-phenyl-2-[(2S)-pyrrolidin-2-yl]pyrrolo[2,1-f][1,2,4]triazine-5-carboxamide
CID 118446035
[4-methyl-3-[(4-methylmorpholin-2-yl)methoxy]-1-phenylpyrazol-5-yl]urea
CID 144629265
2,2-difluoroethyl N-[5-(3,3-difluorocyclobutyl)-4-methyl-2-phenylpyrazol-3-yl]carbamate
CID 170135997
N-(5-cyclopropyl-4-methyl-2-phenylpyrazol-3-yl)-2-fluoro-4,5-dimethoxybenzamide
CID 75468818

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea?
The IUPAC name of [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea (CID 123257754) is [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea.
What is the SMILES notation for [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea?
The canonical SMILES for [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea is Cc1c([C@H]2CCCN2)nn(-c2ccccc2)c1NC(N)=O.
What is the InChIKey of [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea?
The InChIKey is OKNOQFRKWSWLDS-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H19N5O/c1-10-13(12-8-5-9-17-12)19-20(14(10)18-15(16)21)11-6-3-2-4-7-11/h2-4,6-7,12,17H,5,8-9H2,1H3,(H3,16,18,21)/t12-/m1/s1.
What are the key properties of [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea?
[4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea has a molecular weight of 285.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-phenyl-5-[(2R)-pyrrolidin-2-yl]pyrazol-3-yl]urea is sourced from PubChem (CID 123257754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).