2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide

C18H17ClN4O — CID 70783723

IUPAC2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
SMILESCn1c(-c2ccccc2Cl)nc2cc(C(=O)NCC3CC3)cnc21
InChIInChI=1S/C18H17ClN4O/c1-23-16(13-4-2-3-5-14(13)19)22-15-8-12(10-20-17(15)23)18(24)21-9-11-6-7-11/h2-5,8,10-11H,6-7,9H2,1H3,(H,21,24)
InChIKeyVASCDDVLTUEUKI-UHFFFAOYSA-N
MW340.81 g/mol
LogP3.43
Rot. Bonds4

About 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide

2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 70783723) has the molecular formula C18H17ClN4O and a molecular weight of 340.81 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
PubChem CID70783723
Molecular FormulaC18H17ClN4O
Molecular Weight340.81 g/mol
Exact Mass340.11
IUPAC Name2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
SMILESCn1c(-c2ccccc2Cl)nc2cc(C(=O)NCC3CC3)cnc21
InChIInChI=1S/C18H17ClN4O/c1-23-16(13-4-2-3-5-14(13)19)22-15-8-12(10-20-17(15)23)18(24)21-9-11-6-7-11/h2-5,8,10-11H,6-7,9H2,1H3,(H,21,24)
InChIKeyVASCDDVLTUEUKI-UHFFFAOYSA-N
XLogP3.43
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide (CID 70783723) is 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide is Cn1c(-c2ccccc2Cl)nc2cc(C(=O)NCC3CC3)cnc21.
What is the InChIKey of 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is VASCDDVLTUEUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O/c1-23-16(13-4-2-3-5-14(13)19)22-15-8-12(10-20-17(15)23)18(24)21-9-11-6-7-11/h2-5,8,10-11H,6-7,9H2,1H3,(H,21,24).
What are the key properties of 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide?
2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 340.81 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(cyclopropylmethyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 70783723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).