N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide

C15H18N4O — CID 61366016

IUPACN-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)Nc1ccc(-c2ccn[nH]2)cc1
InChIInChI=1S/C15H18N4O/c20-15(10-13-2-1-8-16-13)18-12-5-3-11(4-6-12)14-7-9-17-19-14/h3-7,9,13,16H,1-2,8,10H2,(H,17,19)(H,18,20)
InChIKeyXSDWCRJPUMUALM-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.16
Rot. Bonds4

About N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide

N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 61366016) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide
PubChem CID61366016
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)Nc1ccc(-c2ccn[nH]2)cc1
InChIInChI=1S/C15H18N4O/c20-15(10-13-2-1-8-16-13)18-12-5-3-11(4-6-12)14-7-9-17-19-14/h3-7,9,13,16H,1-2,8,10H2,(H,17,19)(H,18,20)
InChIKeyXSDWCRJPUMUALM-UHFFFAOYSA-N
XLogP2.16
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
N-(4-chlorophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119671239
N-[4-(pyridin-4-ylmethyl)phenyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119828990
2-[4-[(2-pyrrolidin-2-ylacetyl)amino]phenyl]acetic acid
CID 61366052
2-(cyclopropylmethoxy)-N-[4-(1H-pyrazol-5-yl)phenyl]acetamide
CID 51081144
N-(4-pentylphenyl)-2-pyrrolidin-2-ylacetamide
CID 61363717
N-(1H-indazol-5-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119683903
N-[4-(4-methyl-1,3-thiazol-2-yl)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119759367
2-[(2R)-pyrrolidin-2-yl]-N-[4-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]acetamide
CID 167840711
N-phenyl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119756453
N-[4-(2-oxoimidazolidin-1-yl)phenyl]-2-pyrrolidin-2-ylacetamide
CID 61365614
N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]-2-pyrrolidin-2-ylacetamide
CID 119840808

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide (CID 61366016) is N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide is O=C(CC1CCCN1)Nc1ccc(-c2ccn[nH]2)cc1.
What is the InChIKey of N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is XSDWCRJPUMUALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(10-13-2-1-8-16-13)18-12-5-3-11(4-6-12)14-7-9-17-19-14/h3-7,9,13,16H,1-2,8,10H2,(H,17,19)(H,18,20).
What are the key properties of N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide?
N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 270.34 g/mol, XLogP of 2.16, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-pyrazol-5-yl)phenyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 61366016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).