(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol

C22H23F2N3O — CID 134381379

IUPAC(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol
SMILESOC(c1c(C2CC2)ccn2cncc12)C1CCN(c2ccc(F)c(F)c2)CC1
InChIInChI=1S/C22H23F2N3O/c23-18-4-3-16(11-19(18)24)26-8-5-15(6-9-26)22(28)21-17(14-1-2-14)7-10-27-13-25-12-20(21)27/h3-4,7,10-15,22,28H,1-2,5-6,8-9H2
InChIKeyNGUPEVUKQOXEAT-UHFFFAOYSA-N
MW383.44 g/mol
LogP4.44
Rot. Bonds4

About (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol

(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol (PubChem CID 134381379) has the molecular formula C22H23F2N3O and a molecular weight of 383.44 g/mol. Its IUPAC name is (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol
PubChem CID134381379
Molecular FormulaC22H23F2N3O
Molecular Weight383.44 g/mol
Exact Mass383.18
IUPAC Name(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol
SMILESOC(c1c(C2CC2)ccn2cncc12)C1CCN(c2ccc(F)c(F)c2)CC1
InChIInChI=1S/C22H23F2N3O/c23-18-4-3-16(11-19(18)24)26-8-5-15(6-9-26)22(28)21-17(14-1-2-14)7-10-27-13-25-12-20(21)27/h3-4,7,10-15,22,28H,1-2,5-6,8-9H2
InChIKeyNGUPEVUKQOXEAT-UHFFFAOYSA-N
XLogP4.44
TPSA40.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.44
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol?
The IUPAC name of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol (CID 134381379) is (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol.
What is the SMILES notation for (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol?
The canonical SMILES for (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol is OC(c1c(C2CC2)ccn2cncc12)C1CCN(c2ccc(F)c(F)c2)CC1.
What is the InChIKey of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol?
The InChIKey is NGUPEVUKQOXEAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23F2N3O/c23-18-4-3-16(11-19(18)24)26-8-5-15(6-9-26)22(28)21-17(14-1-2-14)7-10-27-13-25-12-20(21)27/h3-4,7,10-15,22,28H,1-2,5-6,8-9H2.
What are the key properties of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol?
(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol has a molecular weight of 383.44 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 134381379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).