(3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone

C19H23N3O2 — CID 3235362

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
SMILESCc1noc(C)c1C(=O)N1CCC2(CC1)CN(c1ccccc1)C2
InChIInChI=1S/C19H23N3O2/c1-14-17(15(2)24-20-14)18(23)21-10-8-19(9-11-21)12-22(13-19)16-6-4-3-5-7-16/h3-7H,8-13H2,1-2H3
InChIKeyNNBJJKIKJRKVRN-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.03
Rot. Bonds2

About (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone

(3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone (PubChem CID 3235362) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
PubChem CID3235362
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
SMILESCc1noc(C)c1C(=O)N1CCC2(CC1)CN(c1ccccc1)C2
InChIInChI=1S/C19H23N3O2/c1-14-17(15(2)24-20-14)18(23)21-10-8-19(9-11-21)12-22(13-19)16-6-4-3-5-7-16/h3-7H,8-13H2,1-2H3
InChIKeyNNBJJKIKJRKVRN-UHFFFAOYSA-N
XLogP3.03
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone (CID 3235362) is (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone is Cc1noc(C)c1C(=O)N1CCC2(CC1)CN(c1ccccc1)C2.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone?
The InChIKey is NNBJJKIKJRKVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-14-17(15(2)24-20-14)18(23)21-10-8-19(9-11-21)12-22(13-19)16-6-4-3-5-7-16/h3-7H,8-13H2,1-2H3.
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone?
(3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone has a molecular weight of 325.41 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)-(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)methanone is sourced from PubChem (CID 3235362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).