(2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide

C18H17FN4O — CID 46900277

IUPAC(2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide
SMILESN[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2cn[nH]c2)cc1
InChIInChI=1S/C18H17FN4O/c19-15-3-1-2-12(8-15)9-17(20)18(24)23-16-6-4-13(5-7-16)14-10-21-22-11-14/h1-8,10-11,17H,9,20H2,(H,21,22)(H,23,24)/t17-/m1/s1
InChIKeyNDENTRIWSKFVRD-QGZVFWFLSA-N
MW324.36 g/mol
LogP2.72
Rot. Bonds5

About (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide

(2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide (PubChem CID 46900277) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide
PubChem CID46900277
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC Name(2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide
SMILESN[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2cn[nH]c2)cc1
InChIInChI=1S/C18H17FN4O/c19-15-3-1-2-12(8-15)9-17(20)18(24)23-16-6-4-13(5-7-16)14-10-21-22-11-14/h1-8,10-11,17H,9,20H2,(H,21,22)(H,23,24)/t17-/m1/s1
InChIKeyNDENTRIWSKFVRD-QGZVFWFLSA-N
XLogP2.72
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide 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

(4E)-N-(4-fluorophenyl)-4-[(phenylcarbonyl)imino]-4H-pyrazole-3-carboxamide
CID 24864078
(((2,6-difluorophenyl)carbonyl)amino)-N-(4-fluorophenyl)-1H-pyrazole-3-carboxamide
CID 24864079
Pyrazole diamide, 25
CID 24971319
Pyrazole diamide, 27
CID 24971321
N-(4-(1H-Pyrazol-4-yl)phenyl)-2-amino-2-(4-chlorophenyl)-acetamide
CID 46900281
N-(4-fluorophenyl)-4-(2-phenylacetamido)-1H-pyrazole-3-carboxamide
CID 24971316
1-benzyl-3-[4-(1H-pyrazol-4-yl)phenyl]urea
CID 45381162
N,N-diethyl-2-[4-[2-fluoro-4-(5-methyl-1H-pyrazol-3-yl)phenyl]piperazin-1-yl]-2-phenylacetamide
CID 58055750
N,N-diethyl-2-[4-[2-fluoro-4-(1-methylpyrazol-4-yl)phenyl]piperazin-1-yl]-2-phenylacetamide
CID 58055778
N-cyclohexyl-2-(3-fluoro-N-(2-pyrazol-1-ylacetyl)anilino)-2-(2-methylphenyl)acetamide
CID 68056678
N-isopropyl-3-[[4-(1H-pyrazol-4-yl)phenyl]carbamoylamino]benzamide
CID 68520214
Rock-IN-D3
CID 68520643

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide?
The IUPAC name of (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide (CID 46900277) is (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide.
What is the SMILES notation for (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide?
The canonical SMILES for (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide is N[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2cn[nH]c2)cc1.
What is the InChIKey of (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide?
The InChIKey is NDENTRIWSKFVRD-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H17FN4O/c19-15-3-1-2-12(8-15)9-17(20)18(24)23-16-6-4-13(5-7-16)14-10-21-22-11-14/h1-8,10-11,17H,9,20H2,(H,21,22)(H,23,24)/t17-/m1/s1.
What are the key properties of (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide?
(2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide has a molecular weight of 324.36 g/mol, XLogP of 2.72, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-(3-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide is sourced from PubChem (CID 46900277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).