N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide

C21H25N5O — CID 57381224

IUPACN-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
SMILESCc1cc(-c2cnc3c(NCC(C)C)nccn23)ccc1C(=O)NC1CC1
InChIInChI=1S/C21H25N5O/c1-13(2)11-23-19-20-24-12-18(26(20)9-8-22-19)15-4-7-17(14(3)10-15)21(27)25-16-5-6-16/h4,7-10,12-13,16H,5-6,11H2,1-3H3,(H,22,23)(H,25,27)
InChIKeyPVHCHYPHQLKTTA-UHFFFAOYSA-N
MW363.47 g/mol
LogP3.66
Rot. Bonds6

About N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide

N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide (PubChem CID 57381224) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
PubChem CID57381224
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC NameN-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
SMILESCc1cc(-c2cnc3c(NCC(C)C)nccn23)ccc1C(=O)NC1CC1
InChIInChI=1S/C21H25N5O/c1-13(2)11-23-19-20-24-12-18(26(20)9-8-22-19)15-4-7-17(14(3)10-15)21(27)25-16-5-6-16/h4,7-10,12-13,16H,5-6,11H2,1-3H3,(H,22,23)(H,25,27)
InChIKeyPVHCHYPHQLKTTA-UHFFFAOYSA-N
XLogP3.66
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide 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-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The IUPAC name of N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide (CID 57381224) is N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The canonical SMILES for N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide is Cc1cc(-c2cnc3c(NCC(C)C)nccn23)ccc1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The InChIKey is PVHCHYPHQLKTTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-13(2)11-23-19-20-24-12-18(26(20)9-8-22-19)15-4-7-17(14(3)10-15)21(27)25-16-5-6-16/h4,7-10,12-13,16H,5-6,11H2,1-3H3,(H,22,23)(H,25,27).
What are the key properties of N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide has a molecular weight of 363.47 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methyl-4-[8-(2-methylpropylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide is sourced from PubChem (CID 57381224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).