3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine

C10H14N4 — CID 84662739

IUPAC3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine
SMILESCN(C)c1ccnc2[nH]cc(CN)c12
InChIInChI=1S/C10H14N4/c1-14(2)8-3-4-12-10-9(8)7(5-11)6-13-10/h3-4,6H,5,11H2,1-2H3,(H,12,13)
InChIKeyWBAIWTWEAHGLFK-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.09
Rot. Bonds2

About 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine

3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine (PubChem CID 84662739) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine
PubChem CID84662739
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine
SMILESCN(C)c1ccnc2[nH]cc(CN)c12
InChIInChI=1S/C10H14N4/c1-14(2)8-3-4-12-10-9(8)7(5-11)6-13-10/h3-4,6H,5,11H2,1-2H3,(H,12,13)
InChIKeyWBAIWTWEAHGLFK-UHFFFAOYSA-N
XLogP1.09
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine (CID 84662739) is 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine is CN(C)c1ccnc2[nH]cc(CN)c12.
What is the InChIKey of 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
The InChIKey is WBAIWTWEAHGLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-14(2)8-3-4-12-10-9(8)7(5-11)6-13-10/h3-4,6H,5,11H2,1-2H3,(H,12,13).
What are the key properties of 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine has a molecular weight of 190.25 g/mol, XLogP of 1.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N,N-dimethyl-1H-pyrrolo[2,3-b]pyridin-4-amine is sourced from PubChem (CID 84662739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).