4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide

C14H15N3O — CID 154852891

IUPAC4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide
SMILESCN(C(=O)c1ccc(C2CC2)cc1)c1cn[nH]c1
InChIInChI=1S/C14H15N3O/c1-17(13-8-15-16-9-13)14(18)12-6-4-11(5-7-12)10-2-3-10/h4-10H,2-3H2,1H3,(H,15,16)
InChIKeySTQWDJGBXLAZDU-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.56
Rot. Bonds3

About 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide

4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide (PubChem CID 154852891) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide.

Molecular Properties

Compound Name4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide
PubChem CID154852891
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide
SMILESCN(C(=O)c1ccc(C2CC2)cc1)c1cn[nH]c1
InChIInChI=1S/C14H15N3O/c1-17(13-8-15-16-9-13)14(18)12-6-4-11(5-7-12)10-2-3-10/h4-10H,2-3H2,1H3,(H,15,16)
InChIKeySTQWDJGBXLAZDU-UHFFFAOYSA-N
XLogP2.56
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide?
The IUPAC name of 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide (CID 154852891) is 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide.
What is the SMILES notation for 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide?
The canonical SMILES for 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide is CN(C(=O)c1ccc(C2CC2)cc1)c1cn[nH]c1.
What is the InChIKey of 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide?
The InChIKey is STQWDJGBXLAZDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-17(13-8-15-16-9-13)14(18)12-6-4-11(5-7-12)10-2-3-10/h4-10H,2-3H2,1H3,(H,15,16).
What are the key properties of 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide?
4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide has a molecular weight of 241.29 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-methyl-N-(1H-pyrazol-4-yl)benzamide is sourced from PubChem (CID 154852891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).