N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide

C19H20N4O2 — CID 135355120

IUPACN,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide
SMILESCN(C)C(=O)Cn1cc(-c2cn(C)c(=O)cc2-c2ccccc2)cn1
InChIInChI=1S/C19H20N4O2/c1-21(2)19(25)13-23-11-15(10-20-23)17-12-22(3)18(24)9-16(17)14-7-5-4-6-8-14/h4-12H,13H2,1-3H3
InChIKeyRIDPLEPJBFHPJB-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.00
Rot. Bonds4

About N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide

N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide (PubChem CID 135355120) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide
PubChem CID135355120
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide
SMILESCN(C)C(=O)Cn1cc(-c2cn(C)c(=O)cc2-c2ccccc2)cn1
InChIInChI=1S/C19H20N4O2/c1-21(2)19(25)13-23-11-15(10-20-23)17-12-22(3)18(24)9-16(17)14-7-5-4-6-8-14/h4-12H,13H2,1-3H3
InChIKeyRIDPLEPJBFHPJB-UHFFFAOYSA-N
XLogP2.00
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide (CID 135355120) is N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide is CN(C)C(=O)Cn1cc(-c2cn(C)c(=O)cc2-c2ccccc2)cn1.
What is the InChIKey of N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide?
The InChIKey is RIDPLEPJBFHPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-21(2)19(25)13-23-11-15(10-20-23)17-12-22(3)18(24)9-16(17)14-7-5-4-6-8-14/h4-12H,13H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide?
N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 2.00, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-(1-methyl-6-oxo-4-phenyl-3-pyridinyl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 135355120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).