methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine

C83H106N22O — CID 164985576

About methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine

methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine (PubChem CID 164985576) has the molecular formula C83H106N22O and a molecular weight of 1427.91 g/mol. Its IUPAC name is methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine.

Molecular Properties

• Compound Name: methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine
• PubChem CID: 164985576
• Molecular Formula: C83H106N22O
• Molecular Weight: 1427.91 g/mol
• Exact Mass: 1426.89
• IUPAC Name: methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine
• SMILES: C.c1cc2c(cn1)CC(N1CCCCC1)=N2.c1cc2c(cn1)N=C(N1CCCCC1)C2.c1ccc2c(c1)CC(N1CCCCC1)=N2.c1cnc2c(c1)CC(N1CCCCC1)=N2.c1cnc2c(c1)N=C(N1CCCCC1)C2.c1ncc2c(n1)CC(N1CCCCC1)=N2.c1ncc2c(n1)N=C(N1CCOCC1)C2
• InChI: InChI=1S/C13H16N2.4C12H15N3.C11H14N4.C10H12N4O.CH4/c1-4-8-15(9-5-1)13-10-11-6-2-3-7-12(11)14-13;1-2-7-15(8-3-1)12-9-11-10(14-12)5-4-6-13-11;1-2-7-15(8-3-1)11-9-10-5-4-6-13-12(10)14-11;1-2-6-15(7-3-1)12-8-10-9-13-5-4-11(10)14-12;1-2-6-15(7-3-1)12-8-10-4-5-13-9-11(10)14-12;1-2-4-15(5-3-1)11-6-9-10(14-11)7-12-8-13-9;1-3-15-4-2-14(1)9-5-8-6-11-7-12-10(8)13-9;/h2-3,6-7H,1,4-5,8-10H2;2*4-6H,1-3,7-9H2;2*4-5,9H,1-3,6-8H2;7-8H,1-6H2;6-7H,1-5H2;1H4
• InChIKey: GCNDZSNPUSBMSD-UHFFFAOYSA-N
• XLogP: 13.95
• TPSA: 221.55 Ų
• H-Bond Acceptors: 23
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1427.91
LogP ≤ 5	13.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine?

The IUPAC name of methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine (CID 164985576) is methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine.

What is the SMILES notation for methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine?

The canonical SMILES for methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine is C.c1cc2c(cn1)CC(N1CCCCC1)=N2.c1cc2c(cn1)N=C(N1CCCCC1)C2.c1ccc2c(c1)CC(N1CCCCC1)=N2.c1cnc2c(c1)CC(N1CCCCC1)=N2.c1cnc2c(c1)N=C(N1CCCCC1)C2.c1ncc2c(n1)CC(N1CCCCC1)=N2.c1ncc2c(n1)N=C(N1CCOCC1)C2.

What is the InChIKey of methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine?

The InChIKey is GCNDZSNPUSBMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2.4C12H15N3.C11H14N4.C10H12N4O.CH4/c1-4-8-15(9-5-1)13-10-11-6-2-3-7-12(11)14-13;1-2-7-15(8-3-1)12-9-11-10(14-12)5-4-6-13-11;1-2-7-15(8-3-1)11-9-10-5-4-6-13-12(10)14-11;1-2-6-15(7-3-1)12-8-10-9-13-5-4-11(10)14-12;1-2-6-15(7-3-1)12-8-10-4-5-13-9-11(10)14-12;1-2-4-15(5-3-1)11-6-9-10(14-11)7-12-8-13-9;1-3-15-4-2-14(1)9-5-8-6-11-7-12-10(8)13-9;/h2-3,6-7H,1,4-5,8-10H2;2*4-6H,1-3,7-9H2;2*4-5,9H,1-3,6-8H2;7-8H,1-6H2;6-7H,1-5H2;1H4.

What are the key properties of methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine?

methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine has a molecular weight of 1427.91 g/mol, XLogP of 13.95, 0 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for methane;2-piperidin-1-yl-3H-indole;2-piperidin-1-yl-3H-pyrrolo[2,3-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-b]pyridine;2-piperidin-1-yl-3H-pyrrolo[2,3-c]pyridine;2-piperidin-1-yl-3H-pyrrolo[3,2-c]pyridine;6-piperidin-1-yl-7H-pyrrolo[3,2-d]pyrimidine;4-(5H-pyrrolo[2,3-d]pyrimidin-6-yl)morpholine is sourced from PubChem (CID 164985576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).