N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

C18H23N5O2 — CID 109066656

IUPACN-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCCN1CCN(C(=O)c2nc(C(=O)NC3CC3)n3ccccc23)CC1
InChIInChI=1S/C18H23N5O2/c1-2-21-9-11-22(12-10-21)18(25)15-14-5-3-4-8-23(14)16(20-15)17(24)19-13-6-7-13/h3-5,8,13H,2,6-7,9-12H2,1H3,(H,19,24)
InChIKeyWHENRKVLDHFHLU-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.00
Rot. Bonds4

About N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109066656) has the molecular formula C18H23N5O2 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109066656
Molecular FormulaC18H23N5O2
Molecular Weight341.41 g/mol
Exact Mass341.19
IUPAC NameN-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCCN1CCN(C(=O)c2nc(C(=O)NC3CC3)n3ccccc23)CC1
InChIInChI=1S/C18H23N5O2/c1-2-21-9-11-22(12-10-21)18(25)15-14-5-3-4-8-23(14)16(20-15)17(24)19-13-6-7-13/h3-5,8,13H,2,6-7,9-12H2,1H3,(H,19,24)
InChIKeyWHENRKVLDHFHLU-UHFFFAOYSA-N
XLogP1.00
TPSA69.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109066656) is N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is CCN1CCN(C(=O)c2nc(C(=O)NC3CC3)n3ccccc23)CC1.
What is the InChIKey of N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is WHENRKVLDHFHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-2-21-9-11-22(12-10-21)18(25)15-14-5-3-4-8-23(14)16(20-15)17(24)19-13-6-7-13/h3-5,8,13H,2,6-7,9-12H2,1H3,(H,19,24).
What are the key properties of N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(4-ethylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109066656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).