N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide

C18H19N5O3 — CID 91422628

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide
SMILESCC(C(=O)Nc1cc(C2CC2)[nH]n1)c1ccc(-n2c(O)c[nH]c2=O)cc1
InChIInChI=1S/C18H19N5O3/c1-10(17(25)20-15-8-14(21-22-15)12-2-3-12)11-4-6-13(7-5-11)23-16(24)9-19-18(23)26/h4-10,12,24H,2-3H2,1H3,(H,19,26)(H2,20,21,22,25)
InChIKeyFTXXOVTYDDSHFH-UHFFFAOYSA-N
MW353.38 g/mol
LogP2.21
Rot. Bonds5

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide (PubChem CID 91422628) has the molecular formula C18H19N5O3 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide
PubChem CID91422628
Molecular FormulaC18H19N5O3
Molecular Weight353.38 g/mol
Exact Mass353.15
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide
SMILESCC(C(=O)Nc1cc(C2CC2)[nH]n1)c1ccc(-n2c(O)c[nH]c2=O)cc1
InChIInChI=1S/C18H19N5O3/c1-10(17(25)20-15-8-14(21-22-15)12-2-3-12)11-4-6-13(7-5-11)23-16(24)9-19-18(23)26/h4-10,12,24H,2-3H2,1H3,(H,19,26)(H2,20,21,22,25)
InChIKeyFTXXOVTYDDSHFH-UHFFFAOYSA-N
XLogP2.21
TPSA115.80 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

CID 5330942
CID 5330942
CID 5330943
CID 5330943
CID 5330949
CID 5330949
CID 5330950
CID 5330950
CID 5330951
CID 5330951
CID 5330952
CID 5330952
CID 5330953
CID 5330953
CID 5330955
CID 5330955
CID 5330961
CID 5330961
CID 5330962
CID 5330962
CID 5330967
CID 5330967
CID 5330969
CID 5330969

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide (CID 91422628) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide is CC(C(=O)Nc1cc(C2CC2)[nH]n1)c1ccc(-n2c(O)c[nH]c2=O)cc1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
The InChIKey is FTXXOVTYDDSHFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3/c1-10(17(25)20-15-8-14(21-22-15)12-2-3-12)11-4-6-13(7-5-11)23-16(24)9-19-18(23)26/h4-10,12,24H,2-3H2,1H3,(H,19,26)(H2,20,21,22,25).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide has a molecular weight of 353.38 g/mol, XLogP of 2.21, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(4-hydroxy-2-oxo-1H-imidazol-3-yl)phenyl]propanamide is sourced from PubChem (CID 91422628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).