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

C11H13N3O — CID 57421416

IUPACN,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide
SMILESCN(C)C(=O)Cc1c[nH]c2cccnc12
InChIInChI=1S/C11H13N3O/c1-14(2)10(15)6-8-7-13-9-4-3-5-12-11(8)9/h3-5,7,13H,6H2,1-2H3
InChIKeyHWZWQHKFBBSGBW-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.19
Rot. Bonds2

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

N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide (PubChem CID 57421416) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide
PubChem CID57421416
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC NameN,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide
SMILESCN(C)C(=O)Cc1c[nH]c2cccnc12
InChIInChI=1S/C11H13N3O/c1-14(2)10(15)6-8-7-13-9-4-3-5-12-11(8)9/h3-5,7,13H,6H2,1-2H3
InChIKeyHWZWQHKFBBSGBW-UHFFFAOYSA-N
XLogP1.19
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide (CID 57421416) is N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide is CN(C)C(=O)Cc1c[nH]c2cccnc12.
What is the InChIKey of N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide?
The InChIKey is HWZWQHKFBBSGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-14(2)10(15)6-8-7-13-9-4-3-5-12-11(8)9/h3-5,7,13H,6H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide?
N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide has a molecular weight of 203.25 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetamide is sourced from PubChem (CID 57421416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).