N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide

C24H25N5O — CID 57425327

IUPACN-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide
SMILESCCNC(=O)N1CCC(n2cnc3c(-c4ccc5ccccc5c4)ccnc32)CC1
InChIInChI=1S/C24H25N5O/c1-2-25-24(30)28-13-10-20(11-14-28)29-16-27-22-21(9-12-26-23(22)29)19-8-7-17-5-3-4-6-18(17)15-19/h3-9,12,15-16,20H,2,10-11,13-14H2,1H3,(H,25,30)
InChIKeyBGRALSWCZIHMJZ-UHFFFAOYSA-N
MW399.50 g/mol
LogP4.62
Rot. Bonds3

About N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide

N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide (PubChem CID 57425327) has the molecular formula C24H25N5O and a molecular weight of 399.50 g/mol. Its IUPAC name is N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide
PubChem CID57425327
Molecular FormulaC24H25N5O
Molecular Weight399.50 g/mol
Exact Mass399.21
IUPAC NameN-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide
SMILESCCNC(=O)N1CCC(n2cnc3c(-c4ccc5ccccc5c4)ccnc32)CC1
InChIInChI=1S/C24H25N5O/c1-2-25-24(30)28-13-10-20(11-14-28)29-16-27-22-21(9-12-26-23(22)29)19-8-7-17-5-3-4-6-18(17)15-19/h3-9,12,15-16,20H,2,10-11,13-14H2,1H3,(H,25,30)
InChIKeyBGRALSWCZIHMJZ-UHFFFAOYSA-N
XLogP4.62
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.50
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide?
The IUPAC name of N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide (CID 57425327) is N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide?
The canonical SMILES for N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide is CCNC(=O)N1CCC(n2cnc3c(-c4ccc5ccccc5c4)ccnc32)CC1.
What is the InChIKey of N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide?
The InChIKey is BGRALSWCZIHMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O/c1-2-25-24(30)28-13-10-20(11-14-28)29-16-27-22-21(9-12-26-23(22)29)19-8-7-17-5-3-4-6-18(17)15-19/h3-9,12,15-16,20H,2,10-11,13-14H2,1H3,(H,25,30).
What are the key properties of N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide?
N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide has a molecular weight of 399.50 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(7-naphthalen-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 57425327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).