(4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one

C24H29N5O — CID 92562283

IUPAC(4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one
SMILESCc1nc2c(C)cccn2c1CN1C[C@@H](c2cccnc2)[C@@]2(CCCCC(=O)N2)C1
InChIInChI=1S/C24H29N5O/c1-17-7-6-12-29-21(18(2)26-23(17)29)15-28-14-20(19-8-5-11-25-13-19)24(16-28)10-4-3-9-22(30)27-24/h5-8,11-13,20H,3-4,9-10,14-16H2,1-2H3,(H,27,30)/t20-,24+/m0/s1
InChIKeyDROGAZVFAAUKBV-GBXCKJPGSA-N
MW403.53 g/mol
LogP3.37
Rot. Bonds3

About (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one

(4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one (PubChem CID 92562283) has the molecular formula C24H29N5O and a molecular weight of 403.53 g/mol. Its IUPAC name is (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one.

Molecular Properties

Compound Name(4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one
PubChem CID92562283
Molecular FormulaC24H29N5O
Molecular Weight403.53 g/mol
Exact Mass403.24
IUPAC Name(4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one
SMILESCc1nc2c(C)cccn2c1CN1C[C@@H](c2cccnc2)[C@@]2(CCCCC(=O)N2)C1
InChIInChI=1S/C24H29N5O/c1-17-7-6-12-29-21(18(2)26-23(17)29)15-28-14-20(19-8-5-11-25-13-19)24(16-28)10-4-3-9-22(30)27-24/h5-8,11-13,20H,3-4,9-10,14-16H2,1-2H3,(H,27,30)/t20-,24+/m0/s1
InChIKeyDROGAZVFAAUKBV-GBXCKJPGSA-N
XLogP3.37
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.53
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-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 (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one?
The IUPAC name of (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one (CID 92562283) is (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one.
What is the SMILES notation for (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one?
The canonical SMILES for (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one is Cc1nc2c(C)cccn2c1CN1C[C@@H](c2cccnc2)[C@@]2(CCCCC(=O)N2)C1.
What is the InChIKey of (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one?
The InChIKey is DROGAZVFAAUKBV-GBXCKJPGSA-N. The full InChI is InChI=1S/C24H29N5O/c1-17-7-6-12-29-21(18(2)26-23(17)29)15-28-14-20(19-8-5-11-25-13-19)24(16-28)10-4-3-9-22(30)27-24/h5-8,11-13,20H,3-4,9-10,14-16H2,1-2H3,(H,27,30)/t20-,24+/m0/s1.
What are the key properties of (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one?
(4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one has a molecular weight of 403.53 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-2-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-4-pyridin-3-yl-2,6-diazaspiro[4.6]undecan-7-one is sourced from PubChem (CID 92562283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).