N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine

C10H13N3 — CID 11542860

IUPACN,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine
SMILESCN(C)Cc1ccc2[nH]ccc2n1
InChIInChI=1S/C10H13N3/c1-13(2)7-8-3-4-9-10(12-8)5-6-11-9/h3-6,11H,7H2,1-2H3
InChIKeyGKGPNOLAJFWGMP-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.62
Rot. Bonds2

About N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine

N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine (PubChem CID 11542860) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine
PubChem CID11542860
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC NameN,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine
SMILESCN(C)Cc1ccc2[nH]ccc2n1
InChIInChI=1S/C10H13N3/c1-13(2)7-8-3-4-9-10(12-8)5-6-11-9/h3-6,11H,7H2,1-2H3
InChIKeyGKGPNOLAJFWGMP-UHFFFAOYSA-N
XLogP1.62
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine (CID 11542860) is N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine is CN(C)Cc1ccc2[nH]ccc2n1.
What is the InChIKey of N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine?
The InChIKey is GKGPNOLAJFWGMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-13(2)7-8-3-4-9-10(12-8)5-6-11-9/h3-6,11H,7H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine?
N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine has a molecular weight of 175.23 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1H-pyrrolo[3,2-b]pyridin-5-yl)methanamine is sourced from PubChem (CID 11542860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).