2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol

C20H23F2N5O — CID 166961620

IUPAC2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
SMILESCC(C)(O)c1ccc2ncc(-c3cccc(N[C@H]4CNCCC4(F)F)n3)n2c1
InChIInChI=1S/C20H23F2N5O/c1-19(2,28)13-6-7-18-24-10-15(27(18)12-13)14-4-3-5-17(25-14)26-16-11-23-9-8-20(16,21)22/h3-7,10,12,16,23,28H,8-9,11H2,1-2H3,(H,25,26)/t16-/m0/s1
InChIKeyIGZHZHVJEZFVIH-INIZCTEOSA-N
MW387.43 g/mol
LogP3.03
Rot. Bonds4

About 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol

2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol (PubChem CID 166961620) has the molecular formula C20H23F2N5O and a molecular weight of 387.43 g/mol. Its IUPAC name is 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol.

Molecular Properties

Compound Name2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
PubChem CID166961620
Molecular FormulaC20H23F2N5O
Molecular Weight387.43 g/mol
Exact Mass387.19
IUPAC Name2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
SMILESCC(C)(O)c1ccc2ncc(-c3cccc(N[C@H]4CNCCC4(F)F)n3)n2c1
InChIInChI=1S/C20H23F2N5O/c1-19(2,28)13-6-7-18-24-10-15(27(18)12-13)14-4-3-5-17(25-14)26-16-11-23-9-8-20(16,21)22/h3-7,10,12,16,23,28H,8-9,11H2,1-2H3,(H,25,26)/t16-/m0/s1
InChIKeyIGZHZHVJEZFVIH-INIZCTEOSA-N
XLogP3.03
TPSA74.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.43
LogP ≤ 53.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-[6-(6-azaspiro[3.4]octan-2-ylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 166961661
N-[(3S,4S)-3-fluoropiperidin-4-yl]-6-(6-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
CID 170240945
N-(4,4-difluoropiperidin-3-yl)-6-imidazo[1,2-a]pyridin-3-ylpyrazin-2-amine
CID 58303530
N-[6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-2-azaspiro[3.3]heptan-6-amine
CID 166961601
(2R)-1,1,1-trifluoro-2-[3-[6-[[(3S,4S)-4-fluoropyrrolidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 167137335
6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-(3,3-dimethylpiperidin-4-yl)pyridin-2-amine
CID 169129916
2-[7-methoxy-3-[6-(pyrrolidin-3-ylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 166961740
3-(6-bromo-2-pyridinyl)-6-tert-butylimidazo[1,2-a]pyridine
CID 166961933
N-[6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine
CID 170646416
1,1,1-trifluoro-2-[3-[4-fluoro-6-[[(3S,4S)-4-fluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 166961583
ethane;N-[6-[6-[1-(trifluoromethyl)cyclopropyl]imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-2-azaspiro[3.3]heptan-6-amine
CID 169129462
N-[(3R,4S)-4-methylpyrrolidin-3-yl]-6-[6-[1-(trifluoromethyl)cyclopropyl]imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine
CID 164560898

Frequently Asked Questions

What is the IUPAC name of 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol?
The IUPAC name of 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol (CID 166961620) is 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol.
What is the SMILES notation for 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol?
The canonical SMILES for 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol is CC(C)(O)c1ccc2ncc(-c3cccc(N[C@H]4CNCCC4(F)F)n3)n2c1.
What is the InChIKey of 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol?
The InChIKey is IGZHZHVJEZFVIH-INIZCTEOSA-N. The full InChI is InChI=1S/C20H23F2N5O/c1-19(2,28)13-6-7-18-24-10-15(27(18)12-13)14-4-3-5-17(25-14)26-16-11-23-9-8-20(16,21)22/h3-7,10,12,16,23,28H,8-9,11H2,1-2H3,(H,25,26)/t16-/m0/s1.
What are the key properties of 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol?
2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol has a molecular weight of 387.43 g/mol, XLogP of 3.03, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[6-[[(3S)-4,4-difluoropiperidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol is sourced from PubChem (CID 166961620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).