N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide

C19H18N4O2 — CID 127039912

IUPACN-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1n[nH]c(-c2ccccn2)c1C1CC1
InChIInChI=1S/C19H18N4O2/c1-25-15-8-3-2-6-13(15)19(24)21-18-16(12-9-10-12)17(22-23-18)14-7-4-5-11-20-14/h2-8,11-12H,9-10H2,1H3,(H2,21,22,23,24)
InChIKeyRPFSVRFQXNWTEI-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.61
Rot. Bonds5

About N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide

N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide (PubChem CID 127039912) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide
PubChem CID127039912
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1n[nH]c(-c2ccccn2)c1C1CC1
InChIInChI=1S/C19H18N4O2/c1-25-15-8-3-2-6-13(15)19(24)21-18-16(12-9-10-12)17(22-23-18)14-7-4-5-11-20-14/h2-8,11-12H,9-10H2,1H3,(H2,21,22,23,24)
InChIKeyRPFSVRFQXNWTEI-UHFFFAOYSA-N
XLogP3.61
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide?
The IUPAC name of N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide (CID 127039912) is N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide.
What is the SMILES notation for N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide?
The canonical SMILES for N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide is COc1ccccc1C(=O)Nc1n[nH]c(-c2ccccn2)c1C1CC1.
What is the InChIKey of N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide?
The InChIKey is RPFSVRFQXNWTEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-25-15-8-3-2-6-13(15)19(24)21-18-16(12-9-10-12)17(22-23-18)14-7-4-5-11-20-14/h2-8,11-12H,9-10H2,1H3,(H2,21,22,23,24).
What are the key properties of N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide?
N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide has a molecular weight of 334.38 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-5-pyridin-2-yl-1H-pyrazol-3-yl)-2-methoxybenzamide is sourced from PubChem (CID 127039912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).