4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one

C23H24ClN5O2 — CID 66794301

IUPAC4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one
SMILESO=c1cc(OCc2ccc(Cl)cn2)ccn1-c1ccc(N2CC3(CCCNC3)C2)nc1
InChIInChI=1S/C23H24ClN5O2/c24-17-2-3-18(26-11-17)13-31-20-6-9-29(22(30)10-20)19-4-5-21(27-12-19)28-15-23(16-28)7-1-8-25-14-23/h2-6,9-12,25H,1,7-8,13-16H2
InChIKeySINBUIRIYKZQBD-UHFFFAOYSA-N
MW437.93 g/mol
LogP3.05
Rot. Bonds5

About 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one

4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one (PubChem CID 66794301) has the molecular formula C23H24ClN5O2 and a molecular weight of 437.93 g/mol. Its IUPAC name is 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one.

Molecular Properties

Compound Name4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one
PubChem CID66794301
Molecular FormulaC23H24ClN5O2
Molecular Weight437.93 g/mol
Exact Mass437.16
IUPAC Name4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one
SMILESO=c1cc(OCc2ccc(Cl)cn2)ccn1-c1ccc(N2CC3(CCCNC3)C2)nc1
InChIInChI=1S/C23H24ClN5O2/c24-17-2-3-18(26-11-17)13-31-20-6-9-29(22(30)10-20)19-4-5-21(27-12-19)28-15-23(16-28)7-1-8-25-14-23/h2-6,9-12,25H,1,7-8,13-16H2
InChIKeySINBUIRIYKZQBD-UHFFFAOYSA-N
XLogP3.05
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.93
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one 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 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one?
The IUPAC name of 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one (CID 66794301) is 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one.
What is the SMILES notation for 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one?
The canonical SMILES for 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one is O=c1cc(OCc2ccc(Cl)cn2)ccn1-c1ccc(N2CC3(CCCNC3)C2)nc1.
What is the InChIKey of 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one?
The InChIKey is SINBUIRIYKZQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN5O2/c24-17-2-3-18(26-11-17)13-31-20-6-9-29(22(30)10-20)19-4-5-21(27-12-19)28-15-23(16-28)7-1-8-25-14-23/h2-6,9-12,25H,1,7-8,13-16H2.
What are the key properties of 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one?
4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one has a molecular weight of 437.93 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-chloro-2-pyridinyl)methoxy]-1-[6-(2,8-diazaspiro[3.5]nonan-2-yl)-3-pyridinyl]pyridin-2-one is sourced from PubChem (CID 66794301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).