7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine

C13H18N2 — CID 91217300

IUPAC7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine
SMILESCCc1ncc(CC(C)C)c2cc[nH]c12
InChIInChI=1S/C13H18N2/c1-4-12-13-11(5-6-14-13)10(8-15-12)7-9(2)3/h5-6,8-9,14H,4,7H2,1-3H3
InChIKeyVPHYPQORIVNHEB-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.32
Rot. Bonds3

About 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine

7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine (PubChem CID 91217300) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine
PubChem CID91217300
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine
SMILESCCc1ncc(CC(C)C)c2cc[nH]c12
InChIInChI=1S/C13H18N2/c1-4-12-13-11(5-6-14-13)10(8-15-12)7-9(2)3/h5-6,8-9,14H,4,7H2,1-3H3
InChIKeyVPHYPQORIVNHEB-UHFFFAOYSA-N
XLogP3.32
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine (CID 91217300) is 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine is CCc1ncc(CC(C)C)c2cc[nH]c12.
What is the InChIKey of 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is VPHYPQORIVNHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-4-12-13-11(5-6-14-13)10(8-15-12)7-9(2)3/h5-6,8-9,14H,4,7H2,1-3H3.
What are the key properties of 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine?
7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 202.30 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-(2-methylpropyl)-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 91217300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).