cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone

C19H23N5O3 — CID 72845195

IUPACcyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone
SMILESCc1cc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)on1
InChIInChI=1S/C19H23N5O3/c1-12-10-15(27-22-12)18(26)23-8-5-19(6-9-23)16-14(20-11-21-16)4-7-24(19)17(25)13-2-3-13/h10-11,13H,2-9H2,1H3,(H,20,21)
InChIKeyMXMFNEOEKHOEAT-UHFFFAOYSA-N
MW369.43 g/mol
LogP1.63
Rot. Bonds2

About cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone

cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone (PubChem CID 72845195) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone
PubChem CID72845195
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC Namecyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone
SMILESCc1cc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)on1
InChIInChI=1S/C19H23N5O3/c1-12-10-15(27-22-12)18(26)23-8-5-19(6-9-23)16-14(20-11-21-16)4-7-24(19)17(25)13-2-3-13/h10-11,13H,2-9H2,1H3,(H,20,21)
InChIKeyMXMFNEOEKHOEAT-UHFFFAOYSA-N
XLogP1.63
TPSA95.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone?
The IUPAC name of cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone (CID 72845195) is cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone.
What is the SMILES notation for cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone?
The canonical SMILES for cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone is Cc1cc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)on1.
What is the InChIKey of cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone?
The InChIKey is MXMFNEOEKHOEAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c1-12-10-15(27-22-12)18(26)23-8-5-19(6-9-23)16-14(20-11-21-16)4-7-24(19)17(25)13-2-3-13/h10-11,13H,2-9H2,1H3,(H,20,21).
What are the key properties of cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone?
cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone has a molecular weight of 369.43 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[1'-(3-methyl-1,2-oxazole-5-carbonyl)spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-5-yl]methanone is sourced from PubChem (CID 72845195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).