N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide

C17H22F3N5O — CID 91911715

IUPACN-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCc1cc(C(F)(F)F)nn1CC(=O)NCCc1ncc(C)n1CC1CC1
InChIInChI=1S/C17H22F3N5O/c1-11-7-14(17(18,19)20)23-25(11)10-16(26)21-6-5-15-22-8-12(2)24(15)9-13-3-4-13/h7-8,13H,3-6,9-10H2,1-2H3,(H,21,26)
InChIKeyYIKQUKLNHIZOCV-UHFFFAOYSA-N
MW369.39 g/mol
LogP2.48
Rot. Bonds7

About N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide

N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide (PubChem CID 91911715) has the molecular formula C17H22F3N5O and a molecular weight of 369.39 g/mol. Its IUPAC name is N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide
PubChem CID91911715
Molecular FormulaC17H22F3N5O
Molecular Weight369.39 g/mol
Exact Mass369.18
IUPAC NameN-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide
SMILESCc1cc(C(F)(F)F)nn1CC(=O)NCCc1ncc(C)n1CC1CC1
InChIInChI=1S/C17H22F3N5O/c1-11-7-14(17(18,19)20)23-25(11)10-16(26)21-6-5-15-22-8-12(2)24(15)9-13-3-4-13/h7-8,13H,3-6,9-10H2,1-2H3,(H,21,26)
InChIKeyYIKQUKLNHIZOCV-UHFFFAOYSA-N
XLogP2.48
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.39
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The IUPAC name of N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide (CID 91911715) is N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The canonical SMILES for N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide is Cc1cc(C(F)(F)F)nn1CC(=O)NCCc1ncc(C)n1CC1CC1.
What is the InChIKey of N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide?
The InChIKey is YIKQUKLNHIZOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22F3N5O/c1-11-7-14(17(18,19)20)23-25(11)10-16(26)21-6-5-15-22-8-12(2)24(15)9-13-3-4-13/h7-8,13H,3-6,9-10H2,1-2H3,(H,21,26).
What are the key properties of N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide?
N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide has a molecular weight of 369.39 g/mol, XLogP of 2.48, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]ethyl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 91911715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).