N-ethylpyrrolo[2,3-b]pyridin-1-amine

C9H11N3 — CID 10419482

IUPACN-ethylpyrrolo[2,3-b]pyridin-1-amine
SMILESCCNn1ccc2cccnc21
InChIInChI=1S/C9H11N3/c1-2-11-12-7-5-8-4-3-6-10-9(8)12/h3-7,11H,2H2,1H3
InChIKeySFENHEDVUVKPKT-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.60
Rot. Bonds2

About N-ethylpyrrolo[2,3-b]pyridin-1-amine

N-ethylpyrrolo[2,3-b]pyridin-1-amine (PubChem CID 10419482) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is N-ethylpyrrolo[2,3-b]pyridin-1-amine.

Molecular Properties

Compound NameN-ethylpyrrolo[2,3-b]pyridin-1-amine
PubChem CID10419482
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC NameN-ethylpyrrolo[2,3-b]pyridin-1-amine
SMILESCCNn1ccc2cccnc21
InChIInChI=1S/C9H11N3/c1-2-11-12-7-5-8-4-3-6-10-9(8)12/h3-7,11H,2H2,1H3
InChIKeySFENHEDVUVKPKT-UHFFFAOYSA-N
XLogP1.60
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethylpyrrolo[2,3-b]pyridin-1-amine?
The IUPAC name of N-ethylpyrrolo[2,3-b]pyridin-1-amine (CID 10419482) is N-ethylpyrrolo[2,3-b]pyridin-1-amine.
What is the SMILES notation for N-ethylpyrrolo[2,3-b]pyridin-1-amine?
The canonical SMILES for N-ethylpyrrolo[2,3-b]pyridin-1-amine is CCNn1ccc2cccnc21.
What is the InChIKey of N-ethylpyrrolo[2,3-b]pyridin-1-amine?
The InChIKey is SFENHEDVUVKPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-2-11-12-7-5-8-4-3-6-10-9(8)12/h3-7,11H,2H2,1H3.
What are the key properties of N-ethylpyrrolo[2,3-b]pyridin-1-amine?
N-ethylpyrrolo[2,3-b]pyridin-1-amine has a molecular weight of 161.21 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylpyrrolo[2,3-b]pyridin-1-amine is sourced from PubChem (CID 10419482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).