(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone

C19H24N4O2 — CID 3234322

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone
SMILESCc1noc(C)c1C(=O)N1CCC[C@@]2(CCN(c3ccccn3)C2)C1
InChIInChI=1S/C19H24N4O2/c1-14-17(15(2)25-21-14)18(24)23-10-5-7-19(13-23)8-11-22(12-19)16-6-3-4-9-20-16/h3-4,6,9H,5,7-8,10-13H2,1-2H3/t19-/m0/s1
InChIKeyGEDXJGPXSZKKNW-IBGZPJMESA-N
MW340.43 g/mol
LogP2.82
Rot. Bonds2

About (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone

(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone (PubChem CID 3234322) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone
PubChem CID3234322
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone
SMILESCc1noc(C)c1C(=O)N1CCC[C@@]2(CCN(c3ccccn3)C2)C1
InChIInChI=1S/C19H24N4O2/c1-14-17(15(2)25-21-14)18(24)23-10-5-7-19(13-23)8-11-22(12-19)16-6-3-4-9-20-16/h3-4,6,9H,5,7-8,10-13H2,1-2H3/t19-/m0/s1
InChIKeyGEDXJGPXSZKKNW-IBGZPJMESA-N
XLogP2.82
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone (CID 3234322) is (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone is Cc1noc(C)c1C(=O)N1CCC[C@@]2(CCN(c3ccccn3)C2)C1.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone?
The InChIKey is GEDXJGPXSZKKNW-IBGZPJMESA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-17(15(2)25-21-14)18(24)23-10-5-7-19(13-23)8-11-22(12-19)16-6-3-4-9-20-16/h3-4,6,9H,5,7-8,10-13H2,1-2H3/t19-/m0/s1.
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone?
(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone has a molecular weight of 340.43 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone is sourced from PubChem (CID 3234322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).