N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide

C25H24N4O — CID 60565634

IUPACN-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
SMILESCc1nccn1-c1ncccc1CNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H24N4O/c1-19-26-15-16-29(19)25-22(13-8-14-27-25)18-28-24(30)17-23(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-16,23H,17-18H2,1H3,(H,28,30)
InChIKeyXULNQWCZHWWOSY-UHFFFAOYSA-N
MW396.49 g/mol
LogP4.41
Rot. Bonds7

About N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide

N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide (PubChem CID 60565634) has the molecular formula C25H24N4O and a molecular weight of 396.49 g/mol. Its IUPAC name is N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
PubChem CID60565634
Molecular FormulaC25H24N4O
Molecular Weight396.49 g/mol
Exact Mass396.20
IUPAC NameN-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
SMILESCc1nccn1-c1ncccc1CNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H24N4O/c1-19-26-15-16-29(19)25-22(13-8-14-27-25)18-28-24(30)17-23(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-16,23H,17-18H2,1H3,(H,28,30)
InChIKeyXULNQWCZHWWOSY-UHFFFAOYSA-N
XLogP4.41
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-butan-2-ylphenoxy)-N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]acetamide
CID 60565665
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
CID 55692566
N-[(1-methylimidazol-2-yl)methyl]-3,3-diphenylpropanamide
CID 110444641
N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]butan-2-amine
CID 130198321
2-methyl-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]propanamide
CID 48734949
(3R)-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]-3-phenylbutanamide
CID 95215139
N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-1-propan-2-ylpiperidine-2-carboxamide
CID 154749067
N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62293470
1-(3-fluoro-4-methylphenyl)-3-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]urea
CID 56818885
N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide
CID 60559095
N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-1-pyridin-3-ylcyclopentane-1-carboxamide
CID 139008860
1-(4-fluorophenyl)-N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]cyclobutane-1-carboxamide
CID 138996652

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
The IUPAC name of N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide (CID 60565634) is N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide is Cc1nccn1-c1ncccc1CNC(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
The InChIKey is XULNQWCZHWWOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O/c1-19-26-15-16-29(19)25-22(13-8-14-27-25)18-28-24(30)17-23(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-16,23H,17-18H2,1H3,(H,28,30).
What are the key properties of N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide has a molecular weight of 396.49 g/mol, XLogP of 4.41, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide is sourced from PubChem (CID 60565634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).