4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide

C19H20N4O — CID 15491330

IUPAC4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide
SMILESCc1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccn1
InChIInChI=1S/C19H20N4O/c1-15-21-12-14-23(15)13-10-19(18(20)24,16-7-3-2-4-8-16)17-9-5-6-11-22-17/h2-9,11-12,14H,10,13H2,1H3,(H2,20,24)
InChIKeyIFMNPLRXAIMAFR-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.45
Rot. Bonds6

About 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide

4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide (PubChem CID 15491330) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide.

Molecular Properties

Compound Name4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide
PubChem CID15491330
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide
SMILESCc1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccn1
InChIInChI=1S/C19H20N4O/c1-15-21-12-14-23(15)13-10-19(18(20)24,16-7-3-2-4-8-16)17-9-5-6-11-22-17/h2-9,11-12,14H,10,13H2,1H3,(H2,20,24)
InChIKeyIFMNPLRXAIMAFR-UHFFFAOYSA-N
XLogP2.45
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide?
The IUPAC name of 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide (CID 15491330) is 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide.
What is the SMILES notation for 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide?
The canonical SMILES for 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide is Cc1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccn1.
What is the InChIKey of 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide?
The InChIKey is IFMNPLRXAIMAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-15-21-12-14-23(15)13-10-19(18(20)24,16-7-3-2-4-8-16)17-9-5-6-11-22-17/h2-9,11-12,14H,10,13H2,1H3,(H2,20,24).
What are the key properties of 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide?
4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide has a molecular weight of 320.40 g/mol, XLogP of 2.45, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylimidazol-1-yl)-2-phenyl-2-pyridin-2-ylbutanamide is sourced from PubChem (CID 15491330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).