N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide

C19H22N6O2 — CID 97447552

IUPACN-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide
SMILESO=C(NC1CC1)c1cn(-c2nc(CN3CCOCC3)c3ccccn23)cn1
InChIInChI=1S/C19H22N6O2/c26-18(21-14-4-5-14)16-12-24(13-20-16)19-22-15(11-23-7-9-27-10-8-23)17-3-1-2-6-25(17)19/h1-3,6,12-14H,4-5,7-11H2,(H,21,26)
InChIKeyPRKFMGPBGTYATH-UHFFFAOYSA-N
MW366.43 g/mol
LogP1.24
Rot. Bonds5

About N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide

N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide (PubChem CID 97447552) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide
PubChem CID97447552
Molecular FormulaC19H22N6O2
Molecular Weight366.43 g/mol
Exact Mass366.18
IUPAC NameN-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide
SMILESO=C(NC1CC1)c1cn(-c2nc(CN3CCOCC3)c3ccccn23)cn1
InChIInChI=1S/C19H22N6O2/c26-18(21-14-4-5-14)16-12-24(13-20-16)19-22-15(11-23-7-9-27-10-8-23)17-3-1-2-6-25(17)19/h1-3,6,12-14H,4-5,7-11H2,(H,21,26)
InChIKeyPRKFMGPBGTYATH-UHFFFAOYSA-N
XLogP1.24
TPSA76.69 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide (CID 97447552) is N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide is O=C(NC1CC1)c1cn(-c2nc(CN3CCOCC3)c3ccccn23)cn1.
What is the InChIKey of N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide?
The InChIKey is PRKFMGPBGTYATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c26-18(21-14-4-5-14)16-12-24(13-20-16)19-22-15(11-23-7-9-27-10-8-23)17-3-1-2-6-25(17)19/h1-3,6,12-14H,4-5,7-11H2,(H,21,26).
What are the key properties of N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide?
N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide has a molecular weight of 366.43 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridin-3-yl]imidazole-4-carboxamide is sourced from PubChem (CID 97447552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).