N-methyl-4-pyrrol-1-ylpyridin-2-amine

C10H11N3 — CID 123180991

IUPACN-methyl-4-pyrrol-1-ylpyridin-2-amine
SMILESCNc1cc(-n2cccc2)ccn1
InChIInChI=1S/C10H11N3/c1-11-10-8-9(4-5-12-10)13-6-2-3-7-13/h2-8H,1H3,(H,11,12)
InChIKeyQOUGROFWEQOEDB-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.91
Rot. Bonds2

About N-methyl-4-pyrrol-1-ylpyridin-2-amine

N-methyl-4-pyrrol-1-ylpyridin-2-amine (PubChem CID 123180991) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is N-methyl-4-pyrrol-1-ylpyridin-2-amine.

Molecular Properties

Compound NameN-methyl-4-pyrrol-1-ylpyridin-2-amine
PubChem CID123180991
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC NameN-methyl-4-pyrrol-1-ylpyridin-2-amine
SMILESCNc1cc(-n2cccc2)ccn1
InChIInChI=1S/C10H11N3/c1-11-10-8-9(4-5-12-10)13-6-2-3-7-13/h2-8H,1H3,(H,11,12)
InChIKeyQOUGROFWEQOEDB-UHFFFAOYSA-N
XLogP1.91
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-pyrrol-1-ylpyridin-2-amine?
The IUPAC name of N-methyl-4-pyrrol-1-ylpyridin-2-amine (CID 123180991) is N-methyl-4-pyrrol-1-ylpyridin-2-amine.
What is the SMILES notation for N-methyl-4-pyrrol-1-ylpyridin-2-amine?
The canonical SMILES for N-methyl-4-pyrrol-1-ylpyridin-2-amine is CNc1cc(-n2cccc2)ccn1.
What is the InChIKey of N-methyl-4-pyrrol-1-ylpyridin-2-amine?
The InChIKey is QOUGROFWEQOEDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-11-10-8-9(4-5-12-10)13-6-2-3-7-13/h2-8H,1H3,(H,11,12).
What are the key properties of N-methyl-4-pyrrol-1-ylpyridin-2-amine?
N-methyl-4-pyrrol-1-ylpyridin-2-amine has a molecular weight of 173.22 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-pyrrol-1-ylpyridin-2-amine is sourced from PubChem (CID 123180991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).