N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide

C19H18N4O2 — CID 134325359

IUPACN-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(O)c2)c1
InChIInChI=1S/C19H18N4O2/c1-12-2-3-13(19(25)22-15-4-5-15)6-18(12)14-8-21-23(11-14)16-7-17(24)10-20-9-16/h2-3,6-11,15,24H,4-5H2,1H3,(H,22,25)
InChIKeyYUDXDEYRTBZMOD-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.84
Rot. Bonds4

About N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide

N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide (PubChem CID 134325359) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide
PubChem CID134325359
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(O)c2)c1
InChIInChI=1S/C19H18N4O2/c1-12-2-3-13(19(25)22-15-4-5-15)6-18(12)14-8-21-23(11-14)16-7-17(24)10-20-9-16/h2-3,6-11,15,24H,4-5H2,1H3,(H,22,25)
InChIKeyYUDXDEYRTBZMOD-UHFFFAOYSA-N
XLogP2.84
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide (CID 134325359) is N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide is Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(O)c2)c1.
What is the InChIKey of N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide?
The InChIKey is YUDXDEYRTBZMOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-12-2-3-13(19(25)22-15-4-5-15)6-18(12)14-8-21-23(11-14)16-7-17(24)10-20-9-16/h2-3,6-11,15,24H,4-5H2,1H3,(H,22,25).
What are the key properties of N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide?
N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide has a molecular weight of 334.38 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[1-(5-hydroxy-3-pyridinyl)pyrazol-4-yl]-4-methylbenzamide is sourced from PubChem (CID 134325359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).