N-ethyl-N-pyrrol-1-ylpyridin-4-amine

C11H13N3 — CID 10845273

IUPACN-ethyl-N-pyrrol-1-ylpyridin-4-amine
SMILESCCN(c1ccncc1)n1cccc1
InChIInChI=1S/C11H13N3/c1-2-14(13-9-3-4-10-13)11-5-7-12-8-6-11/h3-10H,2H2,1H3
InChIKeyDNJVUBHSRZPIGX-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.17
Rot. Bonds3

About N-ethyl-N-pyrrol-1-ylpyridin-4-amine

N-ethyl-N-pyrrol-1-ylpyridin-4-amine (PubChem CID 10845273) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is N-ethyl-N-pyrrol-1-ylpyridin-4-amine.

Molecular Properties

Compound NameN-ethyl-N-pyrrol-1-ylpyridin-4-amine
PubChem CID10845273
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC NameN-ethyl-N-pyrrol-1-ylpyridin-4-amine
SMILESCCN(c1ccncc1)n1cccc1
InChIInChI=1S/C11H13N3/c1-2-14(13-9-3-4-10-13)11-5-7-12-8-6-11/h3-10H,2H2,1H3
InChIKeyDNJVUBHSRZPIGX-UHFFFAOYSA-N
XLogP2.17
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-pyrrol-1-ylpyridin-4-amine?
The IUPAC name of N-ethyl-N-pyrrol-1-ylpyridin-4-amine (CID 10845273) is N-ethyl-N-pyrrol-1-ylpyridin-4-amine.
What is the SMILES notation for N-ethyl-N-pyrrol-1-ylpyridin-4-amine?
The canonical SMILES for N-ethyl-N-pyrrol-1-ylpyridin-4-amine is CCN(c1ccncc1)n1cccc1.
What is the InChIKey of N-ethyl-N-pyrrol-1-ylpyridin-4-amine?
The InChIKey is DNJVUBHSRZPIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-14(13-9-3-4-10-13)11-5-7-12-8-6-11/h3-10H,2H2,1H3.
What are the key properties of N-ethyl-N-pyrrol-1-ylpyridin-4-amine?
N-ethyl-N-pyrrol-1-ylpyridin-4-amine has a molecular weight of 187.25 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-pyrrol-1-ylpyridin-4-amine is sourced from PubChem (CID 10845273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).