N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide

C18H17N3O — CID 4880003

IUPACN-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NC1CCCc2ccccc21)c1cn2ccccc2n1
InChIInChI=1S/C18H17N3O/c22-18(16-12-21-11-4-3-10-17(21)19-16)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-4,6,8,10-12,15H,5,7,9H2,(H,20,22)
InChIKeyHXBZUGYMXBSWBT-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.14
Rot. Bonds2

About N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide

N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 4880003) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID4880003
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NC1CCCc2ccccc21)c1cn2ccccc2n1
InChIInChI=1S/C18H17N3O/c22-18(16-12-21-11-4-3-10-17(21)19-16)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-4,6,8,10-12,15H,5,7,9H2,(H,20,22)
InChIKeyHXBZUGYMXBSWBT-UHFFFAOYSA-N
XLogP3.14
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide (CID 4880003) is N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide is O=C(NC1CCCc2ccccc21)c1cn2ccccc2n1.
What is the InChIKey of N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is HXBZUGYMXBSWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c22-18(16-12-21-11-4-3-10-17(21)19-16)20-15-9-5-7-13-6-1-2-8-14(13)15/h1-4,6,8,10-12,15H,5,7,9H2,(H,20,22).
What are the key properties of N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide?
N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 4880003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).