N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane

C21H27F2N5O — CID 156823402

IUPACN-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane
SMILESCCC.O=C(Nc1cn(C2CCCCC2)nc1C(F)F)c1ncn2ccccc12
InChIInChI=1S/C18H19F2N5O.C3H8/c19-17(20)15-13(10-25(23-15)12-6-2-1-3-7-12)22-18(26)16-14-8-4-5-9-24(14)11-21-16;1-3-2/h4-5,8-12,17H,1-3,6-7H2,(H,22,26);3H2,1-2H3
InChIKeyYBGSRPNLNCOVGK-UHFFFAOYSA-N
MW403.48 g/mol
LogP5.64
Rot. Bonds4

About N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane

N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane (PubChem CID 156823402) has the molecular formula C21H27F2N5O and a molecular weight of 403.48 g/mol. Its IUPAC name is N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane.

Molecular Properties

Compound NameN-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane
PubChem CID156823402
Molecular FormulaC21H27F2N5O
Molecular Weight403.48 g/mol
Exact Mass403.22
IUPAC NameN-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane
SMILESCCC.O=C(Nc1cn(C2CCCCC2)nc1C(F)F)c1ncn2ccccc12
InChIInChI=1S/C18H19F2N5O.C3H8/c19-17(20)15-13(10-25(23-15)12-6-2-1-3-7-12)22-18(26)16-14-8-4-5-9-24(14)11-21-16;1-3-2/h4-5,8-12,17H,1-3,6-7H2,(H,22,26);3H2,1-2H3
InChIKeyYBGSRPNLNCOVGK-UHFFFAOYSA-N
XLogP5.64
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.48
LogP ≤ 55.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]-4-methylpyrrolo[1,2-a]pyrimidine-8-carboxamide;propane
CID 156823426
N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]-4-methylpyrrolo[1,2-a]pyrimidine-8-carboxamide
CID 156823427
N-[1-cyclobutyl-3-(difluoromethyl)pyrazol-4-yl]-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;propane
CID 156823634
N-(dicyclopropylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 69007885
N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]-5-[2-hydroxyethyl(propyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 169120995
N-[3-(difluoromethyl)-1-(4-formylcyclohexyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146599059
cyclopropane;N-(2-cyclopropylphenyl)-3-(difluoromethyl)-1-methylpyrazole-4-carboxamide;ethane
CID 143209520
N-[[2-cyclopropyl-1-(hydroxymethyl)cyclohexyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 140545812
N-[1-cyclohexyl-3-(difluoromethoxy)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;methanol
CID 156823602
N-(cyclodecapentaenyl)-2-(1-cycloheptylpyrazol-3-yl)acetamide
CID 177025916
N-[3-(difluoromethyl)-1-(4-formylcyclohexyl)pyrazol-4-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 146599170
N-[3-(difluoromethyl)-1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-5-[[(1R)-2-hydroxycyclohexyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166733514

Frequently Asked Questions

What is the IUPAC name of N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane?
The IUPAC name of N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane (CID 156823402) is N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane.
What is the SMILES notation for N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane?
The canonical SMILES for N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane is CCC.O=C(Nc1cn(C2CCCCC2)nc1C(F)F)c1ncn2ccccc12.
What is the InChIKey of N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane?
The InChIKey is YBGSRPNLNCOVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F2N5O.C3H8/c19-17(20)15-13(10-25(23-15)12-6-2-1-3-7-12)22-18(26)16-14-8-4-5-9-24(14)11-21-16;1-3-2/h4-5,8-12,17H,1-3,6-7H2,(H,22,26);3H2,1-2H3.
What are the key properties of N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane?
N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane has a molecular weight of 403.48 g/mol, XLogP of 5.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclohexyl-3-(difluoromethyl)pyrazol-4-yl]imidazo[1,5-a]pyridine-1-carboxamide;propane is sourced from PubChem (CID 156823402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).