3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide

C20H23N5O — CID 46277271

IUPAC3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILESCc1nc2cccnc2n1-c1cccc(C(=O)NCCN2CCCC2)c1
InChIInChI=1S/C20H23N5O/c1-15-23-18-8-5-9-21-19(18)25(15)17-7-4-6-16(14-17)20(26)22-10-13-24-11-2-3-12-24/h4-9,14H,2-3,10-13H2,1H3,(H,22,26)
InChIKeyVMVFYGIQKRYVHR-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.55
Rot. Bonds5

About 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide

3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide (PubChem CID 46277271) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide.

Molecular Properties

Compound Name3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide
PubChem CID46277271
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILESCc1nc2cccnc2n1-c1cccc(C(=O)NCCN2CCCC2)c1
InChIInChI=1S/C20H23N5O/c1-15-23-18-8-5-9-21-19(18)25(15)17-7-4-6-16(14-17)20(26)22-10-13-24-11-2-3-12-24/h4-9,14H,2-3,10-13H2,1H3,(H,22,26)
InChIKeyVMVFYGIQKRYVHR-UHFFFAOYSA-N
XLogP2.55
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916242
3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-[(4-methylphenyl)methyl]benzamide
CID 20916253
N-[(3-fluorophenyl)methyl]-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916290
3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(thiophen-2-ylmethyl)benzamide
CID 20916275
N-(3-pyrrolidin-1-ylpropyl)-3-(triazolo[4,5-b]pyridin-3-yl)benzamide
CID 53069742
N-[2-(4-methylpiperazin-1-yl)ethyl]-3-(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)benzamide
CID 53148940
3-methyl-N-(2-piperidin-1-ylethyl)benzamide;hydrochloride
CID 126477808
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[3-(2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methanone
CID 20916271
4-chloro-3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CID 46277437
4-chloro-3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-[(3R)-3-pyrrolidin-1-ylbutyl]benzamide
CID 92864305
N-(2-methoxyethyl)-4-methyl-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 46277332
3-iodo-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 60682573

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide?
The IUPAC name of 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide (CID 46277271) is 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide.
What is the SMILES notation for 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide?
The canonical SMILES for 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide is Cc1nc2cccnc2n1-c1cccc(C(=O)NCCN2CCCC2)c1.
What is the InChIKey of 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide?
The InChIKey is VMVFYGIQKRYVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-15-23-18-8-5-9-21-19(18)25(15)17-7-4-6-16(14-17)20(26)22-10-13-24-11-2-3-12-24/h4-9,14H,2-3,10-13H2,1H3,(H,22,26).
What are the key properties of 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide?
3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide has a molecular weight of 349.44 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-pyrrolidin-1-ylethyl)benzamide is sourced from PubChem (CID 46277271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).