(7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine

C19H19F2N5 — CID 163968043

IUPAC(7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine
SMILESFC(F)c1ccc2ncc(-c3cccc(N[C@H]4CNCC45CC5)n3)n2c1
InChIInChI=1S/C19H19F2N5/c20-18(21)12-4-5-17-23-8-14(26(17)10-12)13-2-1-3-16(24-13)25-15-9-22-11-19(15)6-7-19/h1-5,8,10,15,18,22H,6-7,9,11H2,(H,24,25)/t15-/m0/s1
InChIKeySNNSTEZDXSIKQW-HNNXBMFYSA-N
MW355.39 g/mol
LogP3.50
Rot. Bonds4

About (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine

(7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine (PubChem CID 163968043) has the molecular formula C19H19F2N5 and a molecular weight of 355.39 g/mol. Its IUPAC name is (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine.

Molecular Properties

Compound Name(7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine
PubChem CID163968043
Molecular FormulaC19H19F2N5
Molecular Weight355.39 g/mol
Exact Mass355.16
IUPAC Name(7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine
SMILESFC(F)c1ccc2ncc(-c3cccc(N[C@H]4CNCC45CC5)n3)n2c1
InChIInChI=1S/C19H19F2N5/c20-18(21)12-4-5-17-23-8-14(26(17)10-12)13-2-1-3-16(24-13)25-15-9-22-11-19(15)6-7-19/h1-5,8,10,15,18,22H,6-7,9,11H2,(H,24,25)/t15-/m0/s1
InChIKeySNNSTEZDXSIKQW-HNNXBMFYSA-N
XLogP3.50
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine?
The IUPAC name of (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine (CID 163968043) is (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine.
What is the SMILES notation for (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine?
The canonical SMILES for (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine is FC(F)c1ccc2ncc(-c3cccc(N[C@H]4CNCC45CC5)n3)n2c1.
What is the InChIKey of (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine?
The InChIKey is SNNSTEZDXSIKQW-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H19F2N5/c20-18(21)12-4-5-17-23-8-14(26(17)10-12)13-2-1-3-16(24-13)25-15-9-22-11-19(15)6-7-19/h1-5,8,10,15,18,22H,6-7,9,11H2,(H,24,25)/t15-/m0/s1.
What are the key properties of (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine?
(7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine has a molecular weight of 355.39 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-N-[6-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine is sourced from PubChem (CID 163968043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).