3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide

C114H211F4N23O12 — CID 158137557

IUPAC3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2CCOCC2)CC1.CC(C)N1CCC(NC(=O)N2C3CCC2CC3)CC1.CC(C)N1CCC(NC(=O)N2CC3COCC3C2)CC1.CC(C)N1CCC(NC(=O)N2CCC(F)(F)CC2)CC1.CC(C)N1CCC(NC(=O)N2CCC(O)CC2)CC1.CC(C)N1CCC(NC(=O)N2CCCC(F)(F)C2)CC1.CC(C)N1CCC(NC(=O)N2CCOCC2)CC1.CC1CCN(C(=O)NC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C15H27N3O2.C15H27N3O.C15H29N3O.2C14H25F2N3O.C14H27N3O2.C14H26N2O2.C13H25N3O2/c1-11(2)17-5-3-14(4-6-17)16-15(19)18-7-12-9-20-10-13(12)8-18;1-11(2)17-9-7-12(8-10-17)16-15(19)18-13-3-4-14(18)6-5-13;1-12(2)17-10-6-14(7-11-17)16-15(19)18-8-4-13(3)5-9-18;1-11(2)18-7-3-12(4-8-18)17-13(20)19-9-5-14(15,16)6-10-19;1-11(2)18-8-4-12(5-9-18)17-13(20)19-7-3-6-14(15,16)10-19;1-11(2)16-7-3-12(4-8-16)15-14(19)17-9-5-13(18)6-10-17;1-11(2)16-7-3-13(4-8-16)15-14(17)12-5-9-18-10-6-12;1-11(2)15-5-3-12(4-6-15)14-13(17)16-7-9-18-10-8-16/h11-14H,3-10H2,1-2H3,(H,16,19);11-14H,3-10H2,1-2H3,(H,16,19);12-14H,4-11H2,1-3H3,(H,16,19);2*11-12H,3-10H2,1-2H3,(H,17,20);11-13,18H,3-10H2,1-2H3,(H,15,19);11-13H,3-10H2,1-2H3,(H,15,17);11-12H,3-10H2,1-2H3,(H,14,17)
InChIKeyFTNMVYJKUAQHIK-UHFFFAOYSA-N
MW2172.08 g/mol
LogP13.57
Rot. Bonds17

About 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide

3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide (PubChem CID 158137557) has the molecular formula C114H211F4N23O12 and a molecular weight of 2172.08 g/mol. Its IUPAC name is 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide.

Molecular Properties

Compound Name3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide
PubChem CID158137557
Molecular FormulaC114H211F4N23O12
Molecular Weight2172.08 g/mol
Exact Mass2170.65
IUPAC Name3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2CCOCC2)CC1.CC(C)N1CCC(NC(=O)N2C3CCC2CC3)CC1.CC(C)N1CCC(NC(=O)N2CC3COCC3C2)CC1.CC(C)N1CCC(NC(=O)N2CCC(F)(F)CC2)CC1.CC(C)N1CCC(NC(=O)N2CCC(O)CC2)CC1.CC(C)N1CCC(NC(=O)N2CCCC(F)(F)C2)CC1.CC(C)N1CCC(NC(=O)N2CCOCC2)CC1.CC1CCN(C(=O)NC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C15H27N3O2.C15H27N3O.C15H29N3O.2C14H25F2N3O.C14H27N3O2.C14H26N2O2.C13H25N3O2/c1-11(2)17-5-3-14(4-6-17)16-15(19)18-7-12-9-20-10-13(12)8-18;1-11(2)17-9-7-12(8-10-17)16-15(19)18-13-3-4-14(18)6-5-13;1-12(2)17-10-6-14(7-11-17)16-15(19)18-8-4-13(3)5-9-18;1-11(2)18-7-3-12(4-8-18)17-13(20)19-9-5-14(15,16)6-10-19;1-11(2)18-8-4-12(5-9-18)17-13(20)19-7-3-6-14(15,16)10-19;1-11(2)16-7-3-12(4-8-16)15-14(19)17-9-5-13(18)6-10-17;1-11(2)16-7-3-13(4-8-16)15-14(17)12-5-9-18-10-6-12;1-11(2)15-5-3-12(4-6-15)14-13(17)16-7-9-18-10-8-16/h11-14H,3-10H2,1-2H3,(H,16,19);11-14H,3-10H2,1-2H3,(H,16,19);12-14H,4-11H2,1-3H3,(H,16,19);2*11-12H,3-10H2,1-2H3,(H,17,20);11-13,18H,3-10H2,1-2H3,(H,15,19);11-13H,3-10H2,1-2H3,(H,15,17);11-12H,3-10H2,1-2H3,(H,14,17)
InChIKeyFTNMVYJKUAQHIK-UHFFFAOYSA-N
XLogP13.57
TPSA329.32 Ų
H-Bond Donors9
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms153
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002172.08
LogP ≤ 513.57
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1020

Analyze 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide?
The IUPAC name of 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide (CID 158137557) is 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide.
What is the SMILES notation for 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide?
The canonical SMILES for 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide is CC(C)N1CCC(NC(=O)C2CCOCC2)CC1.CC(C)N1CCC(NC(=O)N2C3CCC2CC3)CC1.CC(C)N1CCC(NC(=O)N2CC3COCC3C2)CC1.CC(C)N1CCC(NC(=O)N2CCC(F)(F)CC2)CC1.CC(C)N1CCC(NC(=O)N2CCC(O)CC2)CC1.CC(C)N1CCC(NC(=O)N2CCCC(F)(F)C2)CC1.CC(C)N1CCC(NC(=O)N2CCOCC2)CC1.CC1CCN(C(=O)NC2CCN(C(C)C)CC2)CC1.
What is the InChIKey of 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide?
The InChIKey is FTNMVYJKUAQHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2.C15H27N3O.C15H29N3O.2C14H25F2N3O.C14H27N3O2.C14H26N2O2.C13H25N3O2/c1-11(2)17-5-3-14(4-6-17)16-15(19)18-7-12-9-20-10-13(12)8-18;1-11(2)17-9-7-12(8-10-17)16-15(19)18-13-3-4-14(18)6-5-13;1-12(2)17-10-6-14(7-11-17)16-15(19)18-8-4-13(3)5-9-18;1-11(2)18-7-3-12(4-8-18)17-13(20)19-9-5-14(15,16)6-10-19;1-11(2)18-8-4-12(5-9-18)17-13(20)19-7-3-6-14(15,16)10-19;1-11(2)16-7-3-12(4-8-16)15-14(19)17-9-5-13(18)6-10-17;1-11(2)16-7-3-13(4-8-16)15-14(17)12-5-9-18-10-6-12;1-11(2)15-5-3-12(4-6-15)14-13(17)16-7-9-18-10-8-16/h11-14H,3-10H2,1-2H3,(H,16,19);11-14H,3-10H2,1-2H3,(H,16,19);12-14H,4-11H2,1-3H3,(H,16,19);2*11-12H,3-10H2,1-2H3,(H,17,20);11-13,18H,3-10H2,1-2H3,(H,15,19);11-13H,3-10H2,1-2H3,(H,15,17);11-12H,3-10H2,1-2H3,(H,14,17).
What are the key properties of 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide?
3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide has a molecular weight of 2172.08 g/mol, XLogP of 13.57, 17 rotatable bonds, 9 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4,4-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-hydroxy-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)-7-azabicyclo[2.2.1]heptane-7-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide is sourced from PubChem (CID 158137557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).