1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea

C15H17N7O — CID 71913780

IUPAC1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea
SMILESCCCn1nccc1NC(=O)Nc1cn[nH]c1-c1ccccn1
InChIInChI=1S/C15H17N7O/c1-2-9-22-13(6-8-18-22)20-15(23)19-12-10-17-21-14(12)11-5-3-4-7-16-11/h3-8,10H,2,9H2,1H3,(H,17,21)(H2,19,20,23)
InChIKeyHODYWNJRSCMIPP-UHFFFAOYSA-N
MW311.35 g/mol
LogP2.72
Rot. Bonds5

About 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea

1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea (PubChem CID 71913780) has the molecular formula C15H17N7O and a molecular weight of 311.35 g/mol. Its IUPAC name is 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea.

Molecular Properties

Compound Name1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea
PubChem CID71913780
Molecular FormulaC15H17N7O
Molecular Weight311.35 g/mol
Exact Mass311.15
IUPAC Name1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea
SMILESCCCn1nccc1NC(=O)Nc1cn[nH]c1-c1ccccn1
InChIInChI=1S/C15H17N7O/c1-2-9-22-13(6-8-18-22)20-15(23)19-12-10-17-21-14(12)11-5-3-4-7-16-11/h3-8,10H,2,9H2,1H3,(H,17,21)(H2,19,20,23)
InChIKeyHODYWNJRSCMIPP-UHFFFAOYSA-N
XLogP2.72
TPSA100.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.35
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-(pyrazol-1-ylmethyl)-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
CID 167793596
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CID 166397794
5-ethyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166234581
N-(5-pyridin-2-yl-1H-pyrazol-4-yl)-1,3-oxazole-4-carboxamide
CID 154858973
2-tert-butyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyrimidine-5-carboxamide
CID 166225176
1-(1-oxo-2,3-dihydroisoindol-4-yl)-3-(2-propylpyrazol-3-yl)urea
CID 167770760
2-pyridin-3-yl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetamide
CID 166192558
4-methyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166192549
2-methoxy-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)benzamide
CID 146124376
3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide
CID 86796993
N-(3-methoxypropyl)-N'-(5-pyridin-2-yl-1H-pyrazol-4-yl)oxamide
CID 75443487
(E)-3-(2-bromophenyl)-N-(2-propylpyrazol-3-yl)prop-2-enamide
CID 55673218

Frequently Asked Questions

What is the IUPAC name of 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea?
The IUPAC name of 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea (CID 71913780) is 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea.
What is the SMILES notation for 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea?
The canonical SMILES for 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea is CCCn1nccc1NC(=O)Nc1cn[nH]c1-c1ccccn1.
What is the InChIKey of 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea?
The InChIKey is HODYWNJRSCMIPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N7O/c1-2-9-22-13(6-8-18-22)20-15(23)19-12-10-17-21-14(12)11-5-3-4-7-16-11/h3-8,10H,2,9H2,1H3,(H,17,21)(H2,19,20,23).
What are the key properties of 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea?
1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea has a molecular weight of 311.35 g/mol, XLogP of 2.72, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propylpyrazol-3-yl)-3-(5-pyridin-2-yl-1H-pyrazol-4-yl)urea is sourced from PubChem (CID 71913780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).