N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide

C14H15N3O — CID 168652444

IUPACN-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide
SMILESO=CNc1ccc(-c2cn3c(n2)CCCC3)cc1
InChIInChI=1S/C14H15N3O/c18-10-15-12-6-4-11(5-7-12)13-9-17-8-2-1-3-14(17)16-13/h4-7,9-10H,1-3,8H2,(H,15,18)
InChIKeyKSWOTDLHBNQJOT-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.45
Rot. Bonds3

About N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide

N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide (PubChem CID 168652444) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide
PubChem CID168652444
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide
SMILESO=CNc1ccc(-c2cn3c(n2)CCCC3)cc1
InChIInChI=1S/C14H15N3O/c18-10-15-12-6-4-11(5-7-12)13-9-17-8-2-1-3-14(17)16-13/h4-7,9-10H,1-3,8H2,(H,15,18)
InChIKeyKSWOTDLHBNQJOT-UHFFFAOYSA-N
XLogP2.45
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide?
The IUPAC name of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide (CID 168652444) is N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide.
What is the SMILES notation for N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide?
The canonical SMILES for N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide is O=CNc1ccc(-c2cn3c(n2)CCCC3)cc1.
What is the InChIKey of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide?
The InChIKey is KSWOTDLHBNQJOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c18-10-15-12-6-4-11(5-7-12)13-9-17-8-2-1-3-14(17)16-13/h4-7,9-10H,1-3,8H2,(H,15,18).
What are the key properties of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide?
N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide has a molecular weight of 241.29 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]formamide is sourced from PubChem (CID 168652444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).