4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide

C15H16N4O2 — CID 5330999

IUPAC4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide
SMILESNC(=O)c1ccc(CC(=O)Nc2cc(C3CC3)[nH]n2)cc1
InChIInChI=1S/C15H16N4O2/c16-15(21)11-3-1-9(2-4-11)7-14(20)17-13-8-12(18-19-13)10-5-6-10/h1-4,8,10H,5-7H2,(H2,16,21)(H2,17,18,19,20)
InChIKeyRJESYXNLLLQOLH-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.57
Rot. Bonds5

About 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide

4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide (PubChem CID 5330999) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide
PubChem CID5330999
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide
SMILESNC(=O)c1ccc(CC(=O)Nc2cc(C3CC3)[nH]n2)cc1
InChIInChI=1S/C15H16N4O2/c16-15(21)11-3-1-9(2-4-11)7-14(20)17-13-8-12(18-19-13)10-5-6-10/h1-4,8,10H,5-7H2,(H2,16,21)(H2,17,18,19,20)
InChIKeyRJESYXNLLLQOLH-UHFFFAOYSA-N
XLogP1.57
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

Pnu-292137
CID 449087
N-(5-Cyclopropyl-1h-Pyrazol-3-Yl)Benzamide
CID 449088
N1-(3-phenyl-1H-pyrazol-5-yl)-4-chlorobenzamide
CID 339736
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-fluoro-2-phenylacetamide
CID 5330942
(2S)-2-amino-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-phenylacetamide
CID 5330943
Pha-533533
CID 5330949
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide
CID 5330950
3-Aminopyrazole deriv. 15
CID 5330951
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]propanamide
CID 5330952
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxo-5-phenylpyrrolidin-1-yl)phenyl]propanamide
CID 5330953
(2S)-N-(5-Cyclopropyl-1H-pyrazol-3-yl)-2-[4-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]propanamide
CID 5330955
3-Aminopyrazole deriv. 27
CID 5330961

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide (CID 5330999) is 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide is NC(=O)c1ccc(CC(=O)Nc2cc(C3CC3)[nH]n2)cc1.
What is the InChIKey of 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide?
The InChIKey is RJESYXNLLLQOLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c16-15(21)11-3-1-9(2-4-11)7-14(20)17-13-8-12(18-19-13)10-5-6-10/h1-4,8,10H,5-7H2,(H2,16,21)(H2,17,18,19,20).
What are the key properties of 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide?
4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide has a molecular weight of 284.32 g/mol, XLogP of 1.57, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 5330999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).