2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide

C16H19FN4O2 — CID 110017465

IUPAC2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cn1cc(NC2CCc3ccc(F)cc32)cn1)NCCO
InChIInChI=1S/C16H19FN4O2/c17-12-3-1-11-2-4-15(14(11)7-12)20-13-8-19-21(9-13)10-16(23)18-5-6-22/h1,3,7-9,15,20,22H,2,4-6,10H2,(H,18,23)
InChIKeyIGLTVWFPEVKUAU-UHFFFAOYSA-N
MW318.35 g/mol
LogP1.23
Rot. Bonds6

About 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide

2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide (PubChem CID 110017465) has the molecular formula C16H19FN4O2 and a molecular weight of 318.35 g/mol. Its IUPAC name is 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
PubChem CID110017465
Molecular FormulaC16H19FN4O2
Molecular Weight318.35 g/mol
Exact Mass318.15
IUPAC Name2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cn1cc(NC2CCc3ccc(F)cc32)cn1)NCCO
InChIInChI=1S/C16H19FN4O2/c17-12-3-1-11-2-4-15(14(11)7-12)20-13-8-19-21(9-13)10-16(23)18-5-6-22/h1,3,7-9,15,20,22H,2,4-6,10H2,(H,18,23)
InChIKeyIGLTVWFPEVKUAU-UHFFFAOYSA-N
XLogP1.23
TPSA79.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide 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

2-[4-(2,3-dihydro-1H-inden-1-ylamino)pyrazol-1-yl]-N-methylacetamide
CID 60932180
2-[4-[(5-chloro-2-fluorophenyl)methylamino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
CID 110017147
N-(2-hydroxyethyl)-2-[4-[[(1R,2R)-2-methyl-2,3-dihydro-1H-inden-1-yl]amino]pyrazol-1-yl]acetamide
CID 99782204
N-(2-hydroxyethyl)-2-[4-[(3-methylcyclopentyl)amino]pyrazol-1-yl]acetamide
CID 110017089
N-(2-hydroxyethyl)-2-[4-[(2-methylcyclopentyl)amino]pyrazol-1-yl]acetamide
CID 110017367
2-[4-[[(E)-3-(4-fluorophenyl)prop-2-enyl]amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
CID 110017108
2-[4-[1-(5-fluoro-2-pyridinyl)ethylamino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
CID 110017430
2-[4-[1-(4-fluorophenyl)propan-2-ylamino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide
CID 110017463
N-[3-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-4-methylphenyl]-2,2-dimethylpropanamide
CID 166202533
2-[4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)pyrazol-1-yl]-N-methylacetamide
CID 102773495
1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-[1-(2-methylpropyl)pyrazol-4-yl]urea
CID 139011819
(1R)-6-fluoro-N-(3-pyrazol-1-ylpropyl)-2,3-dihydro-1H-inden-1-amine
CID 97229636

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide (CID 110017465) is 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide is O=C(Cn1cc(NC2CCc3ccc(F)cc32)cn1)NCCO.
What is the InChIKey of 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide?
The InChIKey is IGLTVWFPEVKUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4O2/c17-12-3-1-11-2-4-15(14(11)7-12)20-13-8-19-21(9-13)10-16(23)18-5-6-22/h1,3,7-9,15,20,22H,2,4-6,10H2,(H,18,23).
What are the key properties of 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide?
2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide has a molecular weight of 318.35 g/mol, XLogP of 1.23, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pyrazol-1-yl]-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 110017465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).