3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol

C107H127Cl7IN15O9 — CID 161156041

IUPAC3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol
SMILESCC1CCC(C(O)c2cc(Cl)cc3cncn23)CC1.O=C(NC1CCCC(C(O)c2cc(Cl)cc3cncn23)C1)c1cccc(Cl)c1.OC(CC1CCCCC1)c1cc(Cl)cc2cncn12.OC(c1cc(Cl)cc2cncn12)C1CCCC1.OC(c1cc(Cl)cc2cncn12)C1CCCCC1.OC(c1cc(I)cc2cncn12)C1CCCCC1.OCC1(C(O)c2cc(Cl)cc3cncn23)CCCCC1
InChIInChI=1S/C21H21Cl2N3O2.C15H19ClN2O2.2C15H19ClN2O.C14H17ClN2O.C14H17IN2O.C13H15ClN2O/c22-15-5-1-4-14(7-15)21(28)25-17-6-2-3-13(8-17)20(27)19-10-16(23)9-18-11-24-12-26(18)19;16-11-6-12-8-17-10-18(12)13(7-11)14(20)15(9-19)4-2-1-3-5-15;1-10-2-4-11(5-3-10)15(19)14-7-12(16)6-13-8-17-9-18(13)14;16-12-7-13-9-17-10-18(13)14(8-12)15(19)6-11-4-2-1-3-5-11;2*15-11-6-12-8-16-9-17(12)13(7-11)14(18)10-4-2-1-3-5-10;14-10-5-11-7-15-8-16(11)12(6-10)13(17)9-3-1-2-4-9/h1,4-5,7,9-13,17,20,27H,2-3,6,8H2,(H,25,28);6-8,10,14,19-20H,1-5,9H2;6-11,15,19H,2-5H2,1H3;7-11,15,19H,1-6H2;2*6-10,14,18H,1-5H2;5-9,13,17H,1-4H2
InChIKeyUPHOLSHZSVHGGL-UHFFFAOYSA-N
MW2142.36 g/mol
LogP25.83
Rot. Bonds18

About 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol

3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol (PubChem CID 161156041) has the molecular formula C107H127Cl7IN15O9 and a molecular weight of 2142.36 g/mol. Its IUPAC name is 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol.

Molecular Properties

Compound Name3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol
PubChem CID161156041
Molecular FormulaC107H127Cl7IN15O9
Molecular Weight2142.36 g/mol
Exact Mass2137.68
IUPAC Name3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol
SMILESCC1CCC(C(O)c2cc(Cl)cc3cncn23)CC1.O=C(NC1CCCC(C(O)c2cc(Cl)cc3cncn23)C1)c1cccc(Cl)c1.OC(CC1CCCCC1)c1cc(Cl)cc2cncn12.OC(c1cc(Cl)cc2cncn12)C1CCCC1.OC(c1cc(Cl)cc2cncn12)C1CCCCC1.OC(c1cc(I)cc2cncn12)C1CCCCC1.OCC1(C(O)c2cc(Cl)cc3cncn23)CCCCC1
InChIInChI=1S/C21H21Cl2N3O2.C15H19ClN2O2.2C15H19ClN2O.C14H17ClN2O.C14H17IN2O.C13H15ClN2O/c22-15-5-1-4-14(7-15)21(28)25-17-6-2-3-13(8-17)20(27)19-10-16(23)9-18-11-24-12-26(18)19;16-11-6-12-8-17-10-18(12)13(7-11)14(20)15(9-19)4-2-1-3-5-15;1-10-2-4-11(5-3-10)15(19)14-7-12(16)6-13-8-17-9-18(13)14;16-12-7-13-9-17-10-18(13)14(8-12)15(19)6-11-4-2-1-3-5-11;2*15-11-6-12-8-16-9-17(12)13(7-11)14(18)10-4-2-1-3-5-10;14-10-5-11-7-15-8-16(11)12(6-10)13(17)9-3-1-2-4-9/h1,4-5,7,9-13,17,20,27H,2-3,6,8H2,(H,25,28);6-8,10,14,19-20H,1-5,9H2;6-11,15,19H,2-5H2,1H3;7-11,15,19H,1-6H2;2*6-10,14,18H,1-5H2;5-9,13,17H,1-4H2
InChIKeyUPHOLSHZSVHGGL-UHFFFAOYSA-N
XLogP25.83
TPSA312.04 Ų
H-Bond Donors9
H-Bond Acceptors23
Rotatable Bonds18
Heavy Atoms139
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002142.36
LogP ≤ 525.83
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol?
The IUPAC name of 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol (CID 161156041) is 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol.
What is the SMILES notation for 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol?
The canonical SMILES for 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol is CC1CCC(C(O)c2cc(Cl)cc3cncn23)CC1.O=C(NC1CCCC(C(O)c2cc(Cl)cc3cncn23)C1)c1cccc(Cl)c1.OC(CC1CCCCC1)c1cc(Cl)cc2cncn12.OC(c1cc(Cl)cc2cncn12)C1CCCC1.OC(c1cc(Cl)cc2cncn12)C1CCCCC1.OC(c1cc(I)cc2cncn12)C1CCCCC1.OCC1(C(O)c2cc(Cl)cc3cncn23)CCCCC1.
What is the InChIKey of 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol?
The InChIKey is UPHOLSHZSVHGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21Cl2N3O2.C15H19ClN2O2.2C15H19ClN2O.C14H17ClN2O.C14H17IN2O.C13H15ClN2O/c22-15-5-1-4-14(7-15)21(28)25-17-6-2-3-13(8-17)20(27)19-10-16(23)9-18-11-24-12-26(18)19;16-11-6-12-8-17-10-18(12)13(7-11)14(20)15(9-19)4-2-1-3-5-15;1-10-2-4-11(5-3-10)15(19)14-7-12(16)6-13-8-17-9-18(13)14;16-12-7-13-9-17-10-18(13)14(8-12)15(19)6-11-4-2-1-3-5-11;2*15-11-6-12-8-16-9-17(12)13(7-11)14(18)10-4-2-1-3-5-10;14-10-5-11-7-15-8-16(11)12(6-10)13(17)9-3-1-2-4-9/h1,4-5,7,9-13,17,20,27H,2-3,6,8H2,(H,25,28);6-8,10,14,19-20H,1-5,9H2;6-11,15,19H,2-5H2,1H3;7-11,15,19H,1-6H2;2*6-10,14,18H,1-5H2;5-9,13,17H,1-4H2.
What are the key properties of 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol?
3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol has a molecular weight of 2142.36 g/mol, XLogP of 25.83, 18 rotatable bonds, 9 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[3-[(7-chloroimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzamide;1-(7-chloroimidazo[1,5-a]pyridin-5-yl)-2-cyclohexylethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-cyclopentylmethanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-[1-(hydroxymethyl)cyclohexyl]methanol;(7-chloroimidazo[1,5-a]pyridin-5-yl)-(4-methylcyclohexyl)methanol;cyclohexyl-(7-iodoimidazo[1,5-a]pyridin-5-yl)methanol is sourced from PubChem (CID 161156041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).