(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone

C23H22F2N2O — CID 134381665

IUPAC(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone
SMILESO=C(c1c(C2CC2)ccc2cncn12)C1CCC(c2cc(F)cc(F)c2)CC1
InChIInChI=1S/C23H22F2N2O/c24-18-9-17(10-19(25)11-18)14-1-5-16(6-2-14)23(28)22-21(15-3-4-15)8-7-20-12-26-13-27(20)22/h7-16H,1-6H2
InChIKeyLQQWUSOXCANUHZ-UHFFFAOYSA-N
MW380.44 g/mol
LogP5.65
Rot. Bonds4

About (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone

(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone (PubChem CID 134381665) has the molecular formula C23H22F2N2O and a molecular weight of 380.44 g/mol. Its IUPAC name is (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone.

Molecular Properties

Compound Name(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone
PubChem CID134381665
Molecular FormulaC23H22F2N2O
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC Name(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone
SMILESO=C(c1c(C2CC2)ccc2cncn12)C1CCC(c2cc(F)cc(F)c2)CC1
InChIInChI=1S/C23H22F2N2O/c24-18-9-17(10-19(25)11-18)14-1-5-16(6-2-14)23(28)22-21(15-3-4-15)8-7-20-12-26-13-27(20)22/h7-16H,1-6H2
InChIKeyLQQWUSOXCANUHZ-UHFFFAOYSA-N
XLogP5.65
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.44
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(4-fluorophenyl)cyclohexyl]methanone;ethane
CID 142308297
(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(2,4-difluorophenyl)cyclohexyl]methanone
CID 134381771
4-[4-(6-cyclopropylimidazo[1,5-a]pyridine-5-carbonyl)cyclohexyl]-N,N-dimethylbenzamide
CID 134381245
[4-(2-chloro-4-methoxyphenyl)cyclohexyl]-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanone
CID 134381423
(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-(3-fluorophenyl)cyclohexyl]methanone
CID 134381318
(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(S)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol
CID 159435173
cyclohexyl(imidazo[1,5-a]pyridin-5-yl)methanone
CID 122609611
(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(4-fluorophenyl)piperidin-4-yl]methanol;(S)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(4-fluorophenyl)piperidin-4-yl]methanol
CID 159040858
(3-cyclopropyl-6-ethyl-2-pyridinyl)-[4-(3-fluorophenyl)cyclohexyl]methanone
CID 157246275
(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-(4-phenylcyclohexyl)methanol
CID 134381324
3-[4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]phenol
CID 134381831
5-[[4-(4-bromophenyl)cyclohexyl]methyl]-6-cyclopropylimidazo[1,5-a]pyridine
CID 134381220

Frequently Asked Questions

What is the IUPAC name of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone?
The IUPAC name of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone (CID 134381665) is (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone.
What is the SMILES notation for (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone?
The canonical SMILES for (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone is O=C(c1c(C2CC2)ccc2cncn12)C1CCC(c2cc(F)cc(F)c2)CC1.
What is the InChIKey of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone?
The InChIKey is LQQWUSOXCANUHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F2N2O/c24-18-9-17(10-19(25)11-18)14-1-5-16(6-2-14)23(28)22-21(15-3-4-15)8-7-20-12-26-13-27(20)22/h7-16H,1-6H2.
What are the key properties of (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone?
(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone has a molecular weight of 380.44 g/mol, XLogP of 5.65, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[4-(3,5-difluorophenyl)cyclohexyl]methanone is sourced from PubChem (CID 134381665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).