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

C19H21N5O — CID 118732116

IUPACN-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
SMILESCCCNc1nccn2c(-c3ccc(C(=O)NC4CC4)cc3)cnc12
InChIInChI=1S/C19H21N5O/c1-2-9-20-17-18-22-12-16(24(18)11-10-21-17)13-3-5-14(6-4-13)19(25)23-15-7-8-15/h3-6,10-12,15H,2,7-9H2,1H3,(H,20,21)(H,23,25)
InChIKeyMBMZRMHNZZULBD-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.11
Rot. Bonds6

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

N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide (PubChem CID 118732116) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
PubChem CID118732116
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide
SMILESCCCNc1nccn2c(-c3ccc(C(=O)NC4CC4)cc3)cnc12
InChIInChI=1S/C19H21N5O/c1-2-9-20-17-18-22-12-16(24(18)11-10-21-17)13-3-5-14(6-4-13)19(25)23-15-7-8-15/h3-6,10-12,15H,2,7-9H2,1H3,(H,20,21)(H,23,25)
InChIKeyMBMZRMHNZZULBD-UHFFFAOYSA-N
XLogP3.11
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The IUPAC name of N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide (CID 118732116) is N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide is CCCNc1nccn2c(-c3ccc(C(=O)NC4CC4)cc3)cnc12.
What is the InChIKey of N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
The InChIKey is MBMZRMHNZZULBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-2-9-20-17-18-22-12-16(24(18)11-10-21-17)13-3-5-14(6-4-13)19(25)23-15-7-8-15/h3-6,10-12,15H,2,7-9H2,1H3,(H,20,21)(H,23,25).
What are the key properties of N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide?
N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide has a molecular weight of 335.41 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[8-(propylamino)imidazo[1,2-a]pyrazin-3-yl]benzamide is sourced from PubChem (CID 118732116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).