3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide

C19H18N6O — CID 75358553

IUPAC3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide
SMILESCc1ccc2c(cnn2CCC(=O)Nc2cc(-c3ccncc3)[nH]n2)c1
InChIInChI=1S/C19H18N6O/c1-13-2-3-17-15(10-13)12-21-25(17)9-6-19(26)22-18-11-16(23-24-18)14-4-7-20-8-5-14/h2-5,7-8,10-12H,6,9H2,1H3,(H2,22,23,24,26)
InChIKeyOCNAPTMZINRDPY-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.16
Rot. Bonds5

About 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide

3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide (PubChem CID 75358553) has the molecular formula C19H18N6O and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide
PubChem CID75358553
Molecular FormulaC19H18N6O
Molecular Weight346.39 g/mol
Exact Mass346.15
IUPAC Name3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide
SMILESCc1ccc2c(cnn2CCC(=O)Nc2cc(-c3ccncc3)[nH]n2)c1
InChIInChI=1S/C19H18N6O/c1-13-2-3-17-15(10-13)12-21-25(17)9-6-19(26)22-18-11-16(23-24-18)14-4-7-20-8-5-14/h2-5,7-8,10-12H,6,9H2,1H3,(H2,22,23,24,26)
InChIKeyOCNAPTMZINRDPY-UHFFFAOYSA-N
XLogP3.16
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide (CID 75358553) is 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide is Cc1ccc2c(cnn2CCC(=O)Nc2cc(-c3ccncc3)[nH]n2)c1.
What is the InChIKey of 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide?
The InChIKey is OCNAPTMZINRDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O/c1-13-2-3-17-15(10-13)12-21-25(17)9-6-19(26)22-18-11-16(23-24-18)14-4-7-20-8-5-14/h2-5,7-8,10-12H,6,9H2,1H3,(H2,22,23,24,26).
What are the key properties of 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide?
3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide has a molecular weight of 346.39 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylindazol-1-yl)-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 75358553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).