[3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone

C19H24N4O2 — CID 154785572

IUPAC[3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone
SMILESNc1cn[nH]c1C1CCN(C(=O)c2ccc(C3CCOCC3)cc2)C1
InChIInChI=1S/C19H24N4O2/c20-17-11-21-22-18(17)16-5-8-23(12-16)19(24)15-3-1-13(2-4-15)14-6-9-25-10-7-14/h1-4,11,14,16H,5-10,12,20H2,(H,21,22)
InChIKeyOUEOFKZYKPFCIZ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.52
Rot. Bonds3

About [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone

[3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone (PubChem CID 154785572) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone.

Molecular Properties

Compound Name[3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone
PubChem CID154785572
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name[3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone
SMILESNc1cn[nH]c1C1CCN(C(=O)c2ccc(C3CCOCC3)cc2)C1
InChIInChI=1S/C19H24N4O2/c20-17-11-21-22-18(17)16-5-8-23(12-16)19(24)15-3-1-13(2-4-15)14-6-9-25-10-7-14/h1-4,11,14,16H,5-10,12,20H2,(H,21,22)
InChIKeyOUEOFKZYKPFCIZ-UHFFFAOYSA-N
XLogP2.52
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone 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

trans-(1R,2R)-N-(1,3-dimethylpyrazol-4-yl)-N-methyl-2-[4-(1H-pyrazol-5-yl)benzoyl]cyclohexane-1-carboxamide
CID 155524126
US9670142, A81 4'-(2H-pyrazol-3-yl)-biphenyl-4-carboxylic acid methyl-((1R,3S)-3-propionylamino-cyclopentyl)-amide
CID 117763591
(1R,2R)-2-[4-(3-Methyl-1H-pyrazol-5-yl)benzoyl]-N-(1H-pyrazol-4-yl)cyclohexanecarboxamide
CID 122678180
(3aR*,7aS*)-5-methyl-2-[4-(1H-pyrazol-3-yl)benzoyl]-2,3,3a,4,7,7a-hexahydro-1H-isoindole
CID 56865081
[3-[2-(2,6-difluorophenyl)ethyl]piperidin-1-yl]-[4-(1H-pyrazol-5-yl)phenyl]methanone
CID 56876167
(3S*,4R*)-3-methoxy-1-[4-(1H-pyrazol-3-yl)benzoyl]piperidin-4-amine
CID 56877456
(3S*,4R*)-4-(hydroxymethyl)-1-[4-(1H-pyrazol-3-yl)benzoyl]-3-piperidinol
CID 56901223
3-(3-hydroxy-3-methylbutyl)-N-methyl-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 70724107
(3S*,4R*)-N,N-dimethyl-4-(4-methylphenyl)-1-[4-(1H-pyrazol-3-yl)benzoyl]-3-pyrrolidinamine
CID 70773107
N-[2-(3-phenyl-1-piperidinyl)ethyl]-4-(1H-pyrazol-3-yl)benzamide
CID 72838818
N-[2-(2-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]-4-(1H-pyrazol-3-yl)benzamide
CID 72867206
N-[2-(4-Phenylpiperidin-1-YL)ethyl]-4-(1H-pyrazol-3-YL)benzamide
CID 72890537

Frequently Asked Questions

What is the IUPAC name of [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone?
The IUPAC name of [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone (CID 154785572) is [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone.
What is the SMILES notation for [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone?
The canonical SMILES for [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone is Nc1cn[nH]c1C1CCN(C(=O)c2ccc(C3CCOCC3)cc2)C1.
What is the InChIKey of [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone?
The InChIKey is OUEOFKZYKPFCIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c20-17-11-21-22-18(17)16-5-8-23(12-16)19(24)15-3-1-13(2-4-15)14-6-9-25-10-7-14/h1-4,11,14,16H,5-10,12,20H2,(H,21,22).
What are the key properties of [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone?
[3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone has a molecular weight of 340.43 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-amino-1H-pyrazol-5-yl)pyrrolidin-1-yl]-[4-(oxan-4-yl)phenyl]methanone is sourced from PubChem (CID 154785572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).