N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide

C24H22N4O — CID 162471132

IUPACN-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)NC(Cc1ccccc1)c1ncccc1-c1ccccc1
InChIInChI=1S/C24H22N4O/c29-23(18-28-16-8-15-26-28)27-22(17-19-9-3-1-4-10-19)24-21(13-7-14-25-24)20-11-5-2-6-12-20/h1-16,22H,17-18H2,(H,27,29)
InChIKeyDNPCREDVPGULOV-UHFFFAOYSA-N
MW382.47 g/mol
LogP4.05
Rot. Bonds7

About N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide

N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide (PubChem CID 162471132) has the molecular formula C24H22N4O and a molecular weight of 382.47 g/mol. Its IUPAC name is N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide
PubChem CID162471132
Molecular FormulaC24H22N4O
Molecular Weight382.47 g/mol
Exact Mass382.18
IUPAC NameN-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)NC(Cc1ccccc1)c1ncccc1-c1ccccc1
InChIInChI=1S/C24H22N4O/c29-23(18-28-16-8-15-26-28)27-22(17-19-9-3-1-4-10-19)24-21(13-7-14-25-24)20-11-5-2-6-12-20/h1-16,22H,17-18H2,(H,27,29)
InChIKeyDNPCREDVPGULOV-UHFFFAOYSA-N
XLogP4.05
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.47
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide?
The IUPAC name of N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide (CID 162471132) is N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide is O=C(Cn1cccn1)NC(Cc1ccccc1)c1ncccc1-c1ccccc1.
What is the InChIKey of N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide?
The InChIKey is DNPCREDVPGULOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O/c29-23(18-28-16-8-15-26-28)27-22(17-19-9-3-1-4-10-19)24-21(13-7-14-25-24)20-11-5-2-6-12-20/h1-16,22H,17-18H2,(H,27,29).
What are the key properties of N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide?
N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide has a molecular weight of 382.47 g/mol, XLogP of 4.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-phenyl-1-(3-phenyl-2-pyridinyl)ethyl]-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 162471132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).