(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone

C19H21N3O — CID 3233526

IUPAC(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)N1CCC2(CC1)CN(c1ccccc1)C2
InChIInChI=1S/C19H21N3O/c23-18(16-6-10-20-11-7-16)21-12-8-19(9-13-21)14-22(15-19)17-4-2-1-3-5-17/h1-7,10-11H,8-9,12-15H2
InChIKeyWAWYGFAPQWMFQR-UHFFFAOYSA-N
MW307.40 g/mol
LogP2.82
Rot. Bonds2

About (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone

(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone (PubChem CID 3233526) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone.

Molecular Properties

Compound Name(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone
PubChem CID3233526
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)N1CCC2(CC1)CN(c1ccccc1)C2
InChIInChI=1S/C19H21N3O/c23-18(16-6-10-20-11-7-16)21-12-8-19(9-13-21)14-22(15-19)17-4-2-1-3-5-17/h1-7,10-11H,8-9,12-15H2
InChIKeyWAWYGFAPQWMFQR-UHFFFAOYSA-N
XLogP2.82
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone?
The IUPAC name of (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone (CID 3233526) is (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone.
What is the SMILES notation for (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone?
The canonical SMILES for (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone is O=C(c1ccncc1)N1CCC2(CC1)CN(c1ccccc1)C2.
What is the InChIKey of (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone?
The InChIKey is WAWYGFAPQWMFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c23-18(16-6-10-20-11-7-16)21-12-8-19(9-13-21)14-22(15-19)17-4-2-1-3-5-17/h1-7,10-11H,8-9,12-15H2.
What are the key properties of (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone?
(2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone has a molecular weight of 307.40 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyl-2,7-diazaspiro[3.5]nonan-7-yl)-pyridin-4-ylmethanone is sourced from PubChem (CID 3233526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).