(2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine

C11H15N3 — CID 170000384

IUPAC(2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine
SMILESCc1cnc2c(ccn2C[C@@H](C)N)c1
InChIInChI=1S/C11H15N3/c1-8-5-10-3-4-14(7-9(2)12)11(10)13-6-8/h3-6,9H,7,12H2,1-2H3/t9-/m1/s1
InChIKeyOMLJGZYKVSMINE-SECBINFHSA-N
MW189.26 g/mol
LogP1.69
Rot. Bonds2

About (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine

(2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine (PubChem CID 170000384) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine
PubChem CID170000384
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name(2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine
SMILESCc1cnc2c(ccn2C[C@@H](C)N)c1
InChIInChI=1S/C11H15N3/c1-8-5-10-3-4-14(7-9(2)12)11(10)13-6-8/h3-6,9H,7,12H2,1-2H3/t9-/m1/s1
InChIKeyOMLJGZYKVSMINE-SECBINFHSA-N
XLogP1.69
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine?
The IUPAC name of (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine (CID 170000384) is (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine.
What is the SMILES notation for (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine?
The canonical SMILES for (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine is Cc1cnc2c(ccn2C[C@@H](C)N)c1.
What is the InChIKey of (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine?
The InChIKey is OMLJGZYKVSMINE-SECBINFHSA-N. The full InChI is InChI=1S/C11H15N3/c1-8-5-10-3-4-14(7-9(2)12)11(10)13-6-8/h3-6,9H,7,12H2,1-2H3/t9-/m1/s1.
What are the key properties of (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine?
(2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine has a molecular weight of 189.26 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(5-methylpyrrolo[2,3-b]pyridin-1-yl)propan-2-amine is sourced from PubChem (CID 170000384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).