1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea

C14H16N6O — CID 166243941

IUPAC1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea
SMILESO=C(Nc1ccc(C2CC2)nn1)Nc1cn[nH]c1C1CC1
InChIInChI=1S/C14H16N6O/c21-14(16-11-7-15-20-13(11)9-3-4-9)17-12-6-5-10(18-19-12)8-1-2-8/h5-9H,1-4H2,(H,15,20)(H2,16,17,19,21)
InChIKeySFWQZOYHUAYNRH-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.60
Rot. Bonds4

About 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea

1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea (PubChem CID 166243941) has the molecular formula C14H16N6O and a molecular weight of 284.32 g/mol. Its IUPAC name is 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea.

Molecular Properties

Compound Name1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea
PubChem CID166243941
Molecular FormulaC14H16N6O
Molecular Weight284.32 g/mol
Exact Mass284.14
IUPAC Name1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea
SMILESO=C(Nc1ccc(C2CC2)nn1)Nc1cn[nH]c1C1CC1
InChIInChI=1S/C14H16N6O/c21-14(16-11-7-15-20-13(11)9-3-4-9)17-12-6-5-10(18-19-12)8-1-2-8/h5-9H,1-4H2,(H,15,20)(H2,16,17,19,21)
InChIKeySFWQZOYHUAYNRH-UHFFFAOYSA-N
XLogP2.60
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea?
The IUPAC name of 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea (CID 166243941) is 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea.
What is the SMILES notation for 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea?
The canonical SMILES for 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea is O=C(Nc1ccc(C2CC2)nn1)Nc1cn[nH]c1C1CC1.
What is the InChIKey of 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea?
The InChIKey is SFWQZOYHUAYNRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O/c21-14(16-11-7-15-20-13(11)9-3-4-9)17-12-6-5-10(18-19-12)8-1-2-8/h5-9H,1-4H2,(H,15,20)(H2,16,17,19,21).
What are the key properties of 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea?
1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea has a molecular weight of 284.32 g/mol, XLogP of 2.60, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(6-cyclopropylpyridazin-3-yl)urea is sourced from PubChem (CID 166243941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).