1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea

C19H21FN4O2 — CID 58135495

IUPAC1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea
SMILESCOc1ccc(F)cc1-c1ccc2c(NC(=O)NCC(C)C)n[nH]c2c1
InChIInChI=1S/C19H21FN4O2/c1-11(2)10-21-19(25)22-18-14-6-4-12(8-16(14)23-24-18)15-9-13(20)5-7-17(15)26-3/h4-9,11H,10H2,1-3H3,(H3,21,22,23,24,25)
InChIKeyCNEPUFQAMFFCFF-UHFFFAOYSA-N
MW356.40 g/mol
LogP4.16
Rot. Bonds5

About 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea

1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea (PubChem CID 58135495) has the molecular formula C19H21FN4O2 and a molecular weight of 356.40 g/mol. Its IUPAC name is 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea.

Molecular Properties

Compound Name1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea
PubChem CID58135495
Molecular FormulaC19H21FN4O2
Molecular Weight356.40 g/mol
Exact Mass356.16
IUPAC Name1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea
SMILESCOc1ccc(F)cc1-c1ccc2c(NC(=O)NCC(C)C)n[nH]c2c1
InChIInChI=1S/C19H21FN4O2/c1-11(2)10-21-19(25)22-18-14-6-4-12(8-16(14)23-24-18)15-9-13(20)5-7-17(15)26-3/h4-9,11H,10H2,1-3H3,(H3,21,22,23,24,25)
InChIKeyCNEPUFQAMFFCFF-UHFFFAOYSA-N
XLogP4.16
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 54.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea 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

N-(2,4-difluorophenyl)-N'-(4-methoxy-1-methyl-1H-indazol-3-yl)urea
CID 2811425
N-(4-{[(4-phenoxy-1H-indazol-3-yl)amino]methyl}phenyl)acetamide
CID 11257276
N-[4-({[4-(4-fluorophenoxy)-1H-indazol-3-yl]amino}methyl)phenyl]acetamide
CID 11269297
[4-[[(4-methoxy-1H-indazol-3-yl)amino]methyl]-4-phenylcyclohexyl] N-ethylcarbamate
CID 90645436
1-[3-(3-amino-1H-indazol-4-yl)phenyl]-3-(3-methoxyphenyl)urea
CID 122195167
1-[4-(3-amino-1H-indazol-4-yl)phenyl]-3-[4-[2-(dimethylamino)ethoxy]-3-fluorophenyl]urea
CID 122195474
1-cyclopropyl-3-[6-(4-hydroxyphenyl)-1H-indazol-3-yl]urea
CID 137661314
1-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-4-N-hydroxybenzene-1,4-dicarboxamide
CID 145966734
4-N-hydroxy-1-N-[6-(2-methoxyphenyl)-1H-indazol-3-yl]benzene-1,4-dicarboxamide
CID 145977597
N-[6-(2-fluoro-3-methoxyphenyl)-1H-indazol-3-yl]-N'-hydroxyoctanediamide
CID 162643829
N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pentanediamide
CID 162663710
N'-hydroxy-N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]heptanediamide
CID 162665208

Frequently Asked Questions

What is the IUPAC name of 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea?
The IUPAC name of 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea (CID 58135495) is 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea.
What is the SMILES notation for 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea?
The canonical SMILES for 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea is COc1ccc(F)cc1-c1ccc2c(NC(=O)NCC(C)C)n[nH]c2c1.
What is the InChIKey of 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea?
The InChIKey is CNEPUFQAMFFCFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN4O2/c1-11(2)10-21-19(25)22-18-14-6-4-12(8-16(14)23-24-18)15-9-13(20)5-7-17(15)26-3/h4-9,11H,10H2,1-3H3,(H3,21,22,23,24,25).
What are the key properties of 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea?
1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea has a molecular weight of 356.40 g/mol, XLogP of 4.16, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-3-(2-methylpropyl)urea is sourced from PubChem (CID 58135495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).