N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide

C20H23N5O2 — CID 137393554

IUPACN-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide
SMILESCc1ccnc2c1nc(NC(=O)CC(C)(O)c1ccccn1)n2C1CCC1
InChIInChI=1S/C20H23N5O2/c1-13-9-11-22-18-17(13)24-19(25(18)14-6-5-7-14)23-16(26)12-20(2,27)15-8-3-4-10-21-15/h3-4,8-11,14,27H,5-7,12H2,1-2H3,(H,23,24,26)
InChIKeyPBESHXFJGUYTAX-UHFFFAOYSA-N
MW365.44 g/mol
LogP3.10
Rot. Bonds5

About N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide

N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide (PubChem CID 137393554) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide.

Molecular Properties

Compound NameN-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide
PubChem CID137393554
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC NameN-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide
SMILESCc1ccnc2c1nc(NC(=O)CC(C)(O)c1ccccn1)n2C1CCC1
InChIInChI=1S/C20H23N5O2/c1-13-9-11-22-18-17(13)24-19(25(18)14-6-5-7-14)23-16(26)12-20(2,27)15-8-3-4-10-21-15/h3-4,8-11,14,27H,5-7,12H2,1-2H3,(H,23,24,26)
InChIKeyPBESHXFJGUYTAX-UHFFFAOYSA-N
XLogP3.10
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide?
The IUPAC name of N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide (CID 137393554) is N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide.
What is the SMILES notation for N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide?
The canonical SMILES for N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide is Cc1ccnc2c1nc(NC(=O)CC(C)(O)c1ccccn1)n2C1CCC1.
What is the InChIKey of N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide?
The InChIKey is PBESHXFJGUYTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-13-9-11-22-18-17(13)24-19(25(18)14-6-5-7-14)23-16(26)12-20(2,27)15-8-3-4-10-21-15/h3-4,8-11,14,27H,5-7,12H2,1-2H3,(H,23,24,26).
What are the key properties of N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide?
N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide has a molecular weight of 365.44 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclobutyl-7-methylimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-pyridin-2-ylbutanamide is sourced from PubChem (CID 137393554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).