2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine

C13H20N2 — CID 82396461

IUPAC2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
SMILESc1c(C2CCCCC2)[nH]c2c1CCNC2
InChIInChI=1S/C13H20N2/c1-2-4-10(5-3-1)12-8-11-6-7-14-9-13(11)15-12/h8,10,14-15H,1-7,9H2
InChIKeyFFJDWGPPEYYNFX-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.71
Rot. Bonds1

About 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine

2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine (PubChem CID 82396461) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
PubChem CID82396461
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
SMILESc1c(C2CCCCC2)[nH]c2c1CCNC2
InChIInChI=1S/C13H20N2/c1-2-4-10(5-3-1)12-8-11-6-7-14-9-13(11)15-12/h8,10,14-15H,1-7,9H2
InChIKeyFFJDWGPPEYYNFX-UHFFFAOYSA-N
XLogP2.71
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine (CID 82396461) is 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine is c1c(C2CCCCC2)[nH]c2c1CCNC2.
What is the InChIKey of 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is FFJDWGPPEYYNFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-2-4-10(5-3-1)12-8-11-6-7-14-9-13(11)15-12/h8,10,14-15H,1-7,9H2.
What are the key properties of 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine?
2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 204.32 g/mol, XLogP of 2.71, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 82396461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).