1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea

C15H18N4O2 — CID 75482362

IUPAC1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
SMILESCOc1cccc(NC(=O)NC2CCCc3cn[nH]c32)c1
InChIInChI=1S/C15H18N4O2/c1-21-12-6-3-5-11(8-12)17-15(20)18-13-7-2-4-10-9-16-19-14(10)13/h3,5-6,8-9,13H,2,4,7H2,1H3,(H,16,19)(H2,17,18,20)
InChIKeyPUZFKDLMGSIVBI-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.62
Rot. Bonds3

About 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea

1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea (PubChem CID 75482362) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
PubChem CID75482362
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
SMILESCOc1cccc(NC(=O)NC2CCCc3cn[nH]c32)c1
InChIInChI=1S/C15H18N4O2/c1-21-12-6-3-5-11(8-12)17-15(20)18-13-7-2-4-10-9-16-19-14(10)13/h3,5-6,8-9,13H,2,4,7H2,1H3,(H,16,19)(H2,17,18,20)
InChIKeyPUZFKDLMGSIVBI-UHFFFAOYSA-N
XLogP2.62
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-3-[(7S)-4,5,6,7-tetrahydro-1H-indazol-7-yl]urea
CID 97228997
1-(3-methoxyphenyl)-3-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]urea
CID 29028111
1,3-bis(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
CID 155950298
1-[4-(4-methoxyphenyl)butyl]-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
CID 75383168
1-(3-methoxyphenyl)-3-[3-[(3-methoxyphenyl)carbamoylamino]cyclohexyl]urea
CID 10295162
2-(3-ethylphenyl)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
CID 154738802
1-[4-(methoxymethyl)cyclohexyl]-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
CID 128727902
1-(3-methoxyphenyl)-3-pyrrolidin-3-ylurea
CID 61310941
4-[(3-methoxyphenyl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 61190108
1-(3-ethyl-1-methylpyrazol-4-yl)-3-[(7R)-4,5,6,7-tetrahydro-1H-indazol-7-yl]urea
CID 125136371
2-(3-fluorophenyl)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
CID 118740682
1-[(1S)-1-(3-fluoro-4-pyridinyl)ethyl]-3-[(7S)-4,5,6,7-tetrahydro-1H-indazol-7-yl]urea
CID 124729926

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea?
The IUPAC name of 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea (CID 75482362) is 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea.
What is the SMILES notation for 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea?
The canonical SMILES for 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea is COc1cccc(NC(=O)NC2CCCc3cn[nH]c32)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea?
The InChIKey is PUZFKDLMGSIVBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-21-12-6-3-5-11(8-12)17-15(20)18-13-7-2-4-10-9-16-19-14(10)13/h3,5-6,8-9,13H,2,4,7H2,1H3,(H,16,19)(H2,17,18,20).
What are the key properties of 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea?
1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea has a molecular weight of 286.33 g/mol, XLogP of 2.62, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea is sourced from PubChem (CID 75482362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).