3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide

C17H19N5OS — CID 175643815

IUPAC3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCN(Cc1cscn1)C(=O)c1cnc2c(c1)ncn2C1CCCC1
InChIInChI=1S/C17H19N5OS/c1-21(8-13-9-24-11-20-13)17(23)12-6-15-16(18-7-12)22(10-19-15)14-4-2-3-5-14/h6-7,9-11,14H,2-5,8H2,1H3
InChIKeyNUQSQXPMSUYBBQ-UHFFFAOYSA-N
MW341.44 g/mol
LogP3.28
Rot. Bonds4

About 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide

3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 175643815) has the molecular formula C17H19N5OS and a molecular weight of 341.44 g/mol. Its IUPAC name is 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID175643815
Molecular FormulaC17H19N5OS
Molecular Weight341.44 g/mol
Exact Mass341.13
IUPAC Name3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
SMILESCN(Cc1cscn1)C(=O)c1cnc2c(c1)ncn2C1CCCC1
InChIInChI=1S/C17H19N5OS/c1-21(8-13-9-24-11-20-13)17(23)12-6-15-16(18-7-12)22(10-19-15)14-4-2-3-5-14/h6-7,9-11,14H,2-5,8H2,1H3
InChIKeyNUQSQXPMSUYBBQ-UHFFFAOYSA-N
XLogP3.28
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.44
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide (CID 175643815) is 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide is CN(Cc1cscn1)C(=O)c1cnc2c(c1)ncn2C1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is NUQSQXPMSUYBBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5OS/c1-21(8-13-9-24-11-20-13)17(23)12-6-15-16(18-7-12)22(10-19-15)14-4-2-3-5-14/h6-7,9-11,14H,2-5,8H2,1H3.
What are the key properties of 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide?
3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 341.44 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 175643815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).