5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane

C83H165N17 — CID 163987792

About 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane

5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane (PubChem CID 163987792) has the molecular formula C83H165N17 and a molecular weight of 1401.35 g/mol. Its IUPAC name is 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane.

Molecular Properties

• Compound Name: 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane
• PubChem CID: 163987792
• Molecular Formula: C83H165N17
• Molecular Weight: 1401.35 g/mol
• Exact Mass: 1400.34
• IUPAC Name: 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane
• SMILES: CC(C)N1CC2C(N)C2C1.CC(C)N1CC2CC2(N)C1.CC(C)N1CC2CCC2(N)C1.CC(C)N1CC2CCNC2C1.CC(C)N1CC2CNC2C1.CC(C)N1CCC2CCCC2C1.CC(C)N1CCC2CNC2C1.CC(C)N1CCCC2NCCC21.CC(C)N1CCCC2NCCCC21
• InChI: InChI=1S/C11H22N2.C11H21N.C10H20N2.3C9H18N2.3C8H16N2/c1-9(2)13-8-4-5-10-11(13)6-3-7-12-10;1-9(2)12-7-6-10-4-3-5-11(10)8-12;1-8(2)12-7-3-4-9-10(12)5-6-11-9;1-7(2)11-4-3-8-5-10-9(8)6-11;1-7(2)11-5-8-3-4-10-9(8)6-11;1-7(2)11-5-8-3-4-9(8,10)6-11;1-6(2)10-4-7-3-9-8(7)5-10;1-6(2)10-4-7-3-8(7,9)5-10;1-5(2)10-3-6-7(4-10)8(6)9/h9-12H,3-8H2,1-2H3;9-11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;2*7-10H,3-6H2,1-2H3;7-8H,3-6,10H2,1-2H3;6-9H,3-5H2,1-2H3;6-7H,3-5,9H2,1-2H3;5-8H,3-4,9H2,1-2H3
• InChIKey: TXVYNCWLXLCNED-UHFFFAOYSA-N
• XLogP: 8.55
• TPSA: 167.37 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 17
• Rotatable Bonds: 9
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1401.35
LogP ≤ 5	8.55
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane?

The IUPAC name of 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane (CID 163987792) is 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane.

What is the SMILES notation for 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane?

The canonical SMILES for 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane is CC(C)N1CC2C(N)C2C1.CC(C)N1CC2CC2(N)C1.CC(C)N1CC2CCC2(N)C1.CC(C)N1CC2CCNC2C1.CC(C)N1CC2CNC2C1.CC(C)N1CCC2CCCC2C1.CC(C)N1CCC2CNC2C1.CC(C)N1CCCC2NCCC21.CC(C)N1CCCC2NCCCC21.

What is the InChIKey of 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane?

The InChIKey is TXVYNCWLXLCNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.C11H21N.C10H20N2.3C9H18N2.3C8H16N2/c1-9(2)13-8-4-5-10-11(13)6-3-7-12-10;1-9(2)12-7-6-10-4-3-5-11(10)8-12;1-8(2)12-7-3-4-9-10(12)5-6-11-9;1-7(2)11-4-3-8-5-10-9(8)6-11;1-7(2)11-5-8-3-4-10-9(8)6-11;1-7(2)11-5-8-3-4-9(8,10)6-11;1-6(2)10-4-7-3-9-8(7)5-10;1-6(2)10-4-7-3-8(7,9)5-10;1-5(2)10-3-6-7(4-10)8(6)9/h9-12H,3-8H2,1-2H3;9-11H,3-8H2,1-2H3;8-11H,3-7H2,1-2H3;2*7-10H,3-6H2,1-2H3;7-8H,3-6,10H2,1-2H3;6-9H,3-5H2,1-2H3;6-7H,3-5,9H2,1-2H3;5-8H,3-4,9H2,1-2H3.

What are the key properties of 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane?

5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane has a molecular weight of 1401.35 g/mol, XLogP of 8.55, 9 rotatable bonds, 8 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole;2-propan-2-yl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;5-propan-2-yl-2,3,4,4a,6,7,8,8a-octahydro-1H-1,5-naphthyridine;4-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydropyrrolo[3,2-b]pyridine;3-propan-2-yl-3-azabicyclo[3.2.0]heptan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-1-amine;3-propan-2-yl-3-azabicyclo[3.1.0]hexan-6-amine;3-propan-2-yl-3,6-diazabicyclo[3.2.0]heptane;3-propan-2-yl-3,8-diazabicyclo[4.2.0]octane is sourced from PubChem (CID 163987792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).