2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide

C14H18N4O — CID 55132216

IUPAC2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide
SMILESCC(C)n1cc(NC(=O)CNc2ccccc2)cn1
InChIInChI=1S/C14H18N4O/c1-11(2)18-10-13(8-16-18)17-14(19)9-15-12-6-4-3-5-7-12/h3-8,10-11,15H,9H2,1-2H3,(H,17,19)
InChIKeyUCEBSYDDYLELNP-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.51
Rot. Bonds5

About 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide

2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide (PubChem CID 55132216) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide
PubChem CID55132216
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide
SMILESCC(C)n1cc(NC(=O)CNc2ccccc2)cn1
InChIInChI=1S/C14H18N4O/c1-11(2)18-10-13(8-16-18)17-14(19)9-15-12-6-4-3-5-7-12/h3-8,10-11,15H,9H2,1-2H3,(H,17,19)
InChIKeyUCEBSYDDYLELNP-UHFFFAOYSA-N
XLogP2.51
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-anilino-N-(1-methylpyrazol-4-yl)acetamide
CID 54927465
2-[(1-propan-2-ylpyrazol-4-yl)amino]acetic acid
CID 154882060
4-oxo-4-[(1-propan-2-ylpyrazol-4-yl)amino]butanoic acid
CID 62904061
3-amino-N-(1-propan-2-ylpyrazol-4-yl)-3-sulfanylidenepropanamide
CID 62903579
4-hydroxy-N-(1-propan-2-ylpyrazol-4-yl)butanamide
CID 79192619
2-amino-2-phenyl-N-(1-propan-2-ylpyrazol-4-yl)propanamide
CID 62902672
2,2-dimethyl-N-(1-propan-2-ylpyrazol-4-yl)propanamide
CID 62999988
3-(ethylamino)-N-(1-propan-2-ylpyrazol-4-yl)propanamide
CID 62904261
2-(2-cyanophenoxy)-N-(1-propan-2-ylpyrazol-4-yl)acetamide
CID 62904626
N-[4-[(2-anilino-2-oxoethyl)amino]phenyl]-2-methylpropanamide
CID 54830466
N-(1-propan-2-ylpyrazol-4-yl)-2-(propylamino)benzamide
CID 62903618
2-anilino-N-(1-hydroxypropan-2-yl)acetamide
CID 60862778

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide?
The IUPAC name of 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide (CID 55132216) is 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide is CC(C)n1cc(NC(=O)CNc2ccccc2)cn1.
What is the InChIKey of 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide?
The InChIKey is UCEBSYDDYLELNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-11(2)18-10-13(8-16-18)17-14(19)9-15-12-6-4-3-5-7-12/h3-8,10-11,15H,9H2,1-2H3,(H,17,19).
What are the key properties of 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide?
2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide has a molecular weight of 258.32 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(1-propan-2-ylpyrazol-4-yl)acetamide is sourced from PubChem (CID 55132216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).