1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide

C18H23N5O2 — CID 175644781

IUPAC1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2cnc3c(c2)ncn3C2CCCC2)CC1
InChIInChI=1S/C18H23N5O2/c19-16(24)12-5-7-22(8-6-12)18(25)13-9-15-17(20-10-13)23(11-21-15)14-3-1-2-4-14/h9-12,14H,1-8H2,(H2,19,24)
InChIKeyMGJBCTVNONHKGE-UHFFFAOYSA-N
MW341.42 g/mol
LogP1.88
Rot. Bonds3

About 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide

1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide (PubChem CID 175644781) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide
PubChem CID175644781
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2cnc3c(c2)ncn3C2CCCC2)CC1
InChIInChI=1S/C18H23N5O2/c19-16(24)12-5-7-22(8-6-12)18(25)13-9-15-17(20-10-13)23(11-21-15)14-3-1-2-4-14/h9-12,14H,1-8H2,(H2,19,24)
InChIKeyMGJBCTVNONHKGE-UHFFFAOYSA-N
XLogP1.88
TPSA94.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide (CID 175644781) is 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)c2cnc3c(c2)ncn3C2CCCC2)CC1.
What is the InChIKey of 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide?
The InChIKey is MGJBCTVNONHKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c19-16(24)12-5-7-22(8-6-12)18(25)13-9-15-17(20-10-13)23(11-21-15)14-3-1-2-4-14/h9-12,14H,1-8H2,(H2,19,24).
What are the key properties of 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide?
1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide has a molecular weight of 341.42 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentylimidazo[4,5-b]pyridine-6-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 175644781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).