tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate

C19H25N3O3 — CID 56805952

IUPACtert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate
SMILESCC(C)(C)OC(=O)C1(NC(=O)Cc2cn3ccccc3n2)CCCC1
InChIInChI=1S/C19H25N3O3/c1-18(2,3)25-17(24)19(9-5-6-10-19)21-16(23)12-14-13-22-11-7-4-8-15(22)20-14/h4,7-8,11,13H,5-6,9-10,12H2,1-3H3,(H,21,23)
InChIKeyDZZSYJBKOOLIDH-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.65
Rot. Bonds4

About tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate

tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate (PubChem CID 56805952) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate
PubChem CID56805952
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Nametert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate
SMILESCC(C)(C)OC(=O)C1(NC(=O)Cc2cn3ccccc3n2)CCCC1
InChIInChI=1S/C19H25N3O3/c1-18(2,3)25-17(24)19(9-5-6-10-19)21-16(23)12-14-13-22-11-7-4-8-15(22)20-14/h4,7-8,11,13H,5-6,9-10,12H2,1-3H3,(H,21,23)
InChIKeyDZZSYJBKOOLIDH-UHFFFAOYSA-N
XLogP2.65
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate 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 tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate?
The IUPAC name of tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate (CID 56805952) is tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate.
What is the SMILES notation for tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate?
The canonical SMILES for tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate is CC(C)(C)OC(=O)C1(NC(=O)Cc2cn3ccccc3n2)CCCC1.
What is the InChIKey of tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate?
The InChIKey is DZZSYJBKOOLIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-18(2,3)25-17(24)19(9-5-6-10-19)21-16(23)12-14-13-22-11-7-4-8-15(22)20-14/h4,7-8,11,13H,5-6,9-10,12H2,1-3H3,(H,21,23).
What are the key properties of tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate?
tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate has a molecular weight of 343.43 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 1-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]cyclopentane-1-carboxylate is sourced from PubChem (CID 56805952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).