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

C23H27N3O — CID 60559095

IUPACN-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide
SMILESCc1nccn1CC(C)CNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27N3O/c1-18(17-26-14-13-24-19(26)2)16-25-23(27)15-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,18,22H,15-17H2,1-2H3,(H,25,27)
InChIKeyWPLVNTNIPNLCLJ-UHFFFAOYSA-N
MW361.49 g/mol
LogP4.17
Rot. Bonds8

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

N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide (PubChem CID 60559095) has the molecular formula C23H27N3O and a molecular weight of 361.49 g/mol. Its IUPAC name is N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide
PubChem CID60559095
Molecular FormulaC23H27N3O
Molecular Weight361.49 g/mol
Exact Mass361.22
IUPAC NameN-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide
SMILESCc1nccn1CC(C)CNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27N3O/c1-18(17-26-14-13-24-19(26)2)16-25-23(27)15-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,18,22H,15-17H2,1-2H3,(H,25,27)
InChIKeyWPLVNTNIPNLCLJ-UHFFFAOYSA-N
XLogP4.17
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-2-phenylpropanamide;dihydrochloride
CID 120595719
4-amino-3-methoxy-N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]butanamide;dihydrochloride
CID 120595717
N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3-phenylprop-2-enamide
CID 76868468
3-(2-aminophenyl)-N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]propanamide
CID 120612579
4-amino-N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]butanamide;dihydrochloride
CID 119857880
2-amino-N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]propanamide
CID 119857841
N-[(2S)-2-methyl-3-(2-methylimidazol-1-yl)propyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 95278903
1-[[2-(hydroxymethyl)phenyl]methyl]-3-[2-methyl-3-(2-methylimidazol-1-yl)propyl]urea
CID 111435084
N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 60559475
3-(furan-2-yl)-N-[2-(2-methylimidazol-1-yl)ethyl]-3-phenylpropanamide
CID 91768167
1-(2-hydroxy-4-methylpentyl)-3-[2-methyl-3-(2-methylimidazol-1-yl)propyl]urea
CID 110911491
N-[(2R)-2-methyl-3-(2-methylimidazol-1-yl)propyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide
CID 94159666

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide?
The IUPAC name of N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide (CID 60559095) is N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide is Cc1nccn1CC(C)CNC(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide?
The InChIKey is WPLVNTNIPNLCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O/c1-18(17-26-14-13-24-19(26)2)16-25-23(27)15-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,18,22H,15-17H2,1-2H3,(H,25,27).
What are the key properties of N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide?
N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide has a molecular weight of 361.49 g/mol, XLogP of 4.17, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-(2-methylimidazol-1-yl)propyl]-3,3-diphenylpropanamide is sourced from PubChem (CID 60559095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).