1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea

C19H20N4O2 — CID 69061513

IUPAC1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea
SMILESCOc1ccc(-c2ccc3c(NC(=O)NCC4CC4)n[nH]c3c2)cc1
InChIInChI=1S/C19H20N4O2/c1-25-15-7-4-13(5-8-15)14-6-9-16-17(10-14)22-23-18(16)21-19(24)20-11-12-2-3-12/h4-10,12H,2-3,11H2,1H3,(H3,20,21,22,23,24)
InChIKeyDIAOXBSCNWKNNO-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.77
Rot. Bonds5

About 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea

1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea (PubChem CID 69061513) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea
PubChem CID69061513
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea
SMILESCOc1ccc(-c2ccc3c(NC(=O)NCC4CC4)n[nH]c3c2)cc1
InChIInChI=1S/C19H20N4O2/c1-25-15-7-4-13(5-8-15)14-6-9-16-17(10-14)22-23-18(16)21-19(24)20-11-12-2-3-12/h4-10,12H,2-3,11H2,1H3,(H3,20,21,22,23,24)
InChIKeyDIAOXBSCNWKNNO-UHFFFAOYSA-N
XLogP3.77
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-3-propan-2-ylurea
CID 69070012
1-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-3-(3-phenylpropyl)urea
CID 69067411
4-hydroxy-N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
CID 69061015
N-[2-[[6-(4-methylphenyl)-1H-indazol-3-yl]carbamoylamino]ethyl]acetamide
CID 69091931
N-[6-(2,4-dimethoxyphenyl)-1H-indazol-3-yl]cyclohexanecarboxamide
CID 69065277
1-(3-hydroxypropyl)-3-[6-(4-methylphenyl)-1H-indazol-3-yl]urea
CID 69064539
2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide
CID 69061785
2-cyclopentyl-N-[6-(4-fluorophenyl)-1H-indazol-3-yl]acetamide
CID 69060428
N-[6-(4-methoxyphenyl)-1H-indazol-3-yl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 69062932
1-(3-imidazol-1-ylpropyl)-3-[6-(3-methoxyphenyl)-1H-indazol-3-yl]urea
CID 69062294
1-[6-(2-methoxyphenyl)-1H-indazol-3-yl]-3-(3-phenylpropyl)urea
CID 69061205
N-[6-(3-methoxyphenyl)-1H-indazol-3-yl]pyrrolidine-1-carboxamide
CID 69069520

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea?
The IUPAC name of 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea (CID 69061513) is 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea.
What is the SMILES notation for 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea?
The canonical SMILES for 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea is COc1ccc(-c2ccc3c(NC(=O)NCC4CC4)n[nH]c3c2)cc1.
What is the InChIKey of 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea?
The InChIKey is DIAOXBSCNWKNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-25-15-7-4-13(5-8-15)14-6-9-16-17(10-14)22-23-18(16)21-19(24)20-11-12-2-3-12/h4-10,12H,2-3,11H2,1H3,(H3,20,21,22,23,24).
What are the key properties of 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea?
1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea has a molecular weight of 336.40 g/mol, XLogP of 3.77, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-3-[6-(4-methoxyphenyl)-1H-indazol-3-yl]urea is sourced from PubChem (CID 69061513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).