N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide

C22H24N6O — CID 163239121

IUPACN-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide
SMILESO=C(NCc1cn2cc(CNCC3CCC3)ccc2n1)c1cccn2cncc12
InChIInChI=1S/C22H24N6O/c29-22(19-5-2-8-27-15-24-12-20(19)27)25-11-18-14-28-13-17(6-7-21(28)26-18)10-23-9-16-3-1-4-16/h2,5-8,12-16,23H,1,3-4,9-11H2,(H,25,29)
InChIKeyZHAQBUXATNJVBW-UHFFFAOYSA-N
MW388.48 g/mol
LogP2.80
Rot. Bonds7

About N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide

N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide (PubChem CID 163239121) has the molecular formula C22H24N6O and a molecular weight of 388.48 g/mol. Its IUPAC name is N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide
PubChem CID163239121
Molecular FormulaC22H24N6O
Molecular Weight388.48 g/mol
Exact Mass388.20
IUPAC NameN-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide
SMILESO=C(NCc1cn2cc(CNCC3CCC3)ccc2n1)c1cccn2cncc12
InChIInChI=1S/C22H24N6O/c29-22(19-5-2-8-27-15-24-12-20(19)27)25-11-18-14-28-13-17(6-7-21(28)26-18)10-23-9-16-3-1-4-16/h2,5-8,12-16,23H,1,3-4,9-11H2,(H,25,29)
InChIKeyZHAQBUXATNJVBW-UHFFFAOYSA-N
XLogP2.80
TPSA75.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.48
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide?
The IUPAC name of N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide (CID 163239121) is N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide.
What is the SMILES notation for N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide?
The canonical SMILES for N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide is O=C(NCc1cn2cc(CNCC3CCC3)ccc2n1)c1cccn2cncc12.
What is the InChIKey of N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide?
The InChIKey is ZHAQBUXATNJVBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O/c29-22(19-5-2-8-27-15-24-12-20(19)27)25-11-18-14-28-13-17(6-7-21(28)26-18)10-23-9-16-3-1-4-16/h2,5-8,12-16,23H,1,3-4,9-11H2,(H,25,29).
What are the key properties of N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide?
N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide has a molecular weight of 388.48 g/mol, XLogP of 2.80, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]imidazo[1,5-a]pyridine-8-carboxamide is sourced from PubChem (CID 163239121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).