N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide

C18H20N6O — CID 166270149

IUPACN-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
SMILESO=C(NCCn1cc(-c2ccccc2)nn1)C1CCn2ccnc2C1
InChIInChI=1S/C18H20N6O/c25-18(15-6-9-23-10-7-19-17(23)12-15)20-8-11-24-13-16(21-22-24)14-4-2-1-3-5-14/h1-5,7,10,13,15H,6,8-9,11-12H2,(H,20,25)
InChIKeyRWCMVBSVPAYPEB-UHFFFAOYSA-N
MW336.40 g/mol
LogP1.52
Rot. Bonds5

About N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide

N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide (PubChem CID 166270149) has the molecular formula C18H20N6O and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
PubChem CID166270149
Molecular FormulaC18H20N6O
Molecular Weight336.40 g/mol
Exact Mass336.17
IUPAC NameN-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
SMILESO=C(NCCn1cc(-c2ccccc2)nn1)C1CCn2ccnc2C1
InChIInChI=1S/C18H20N6O/c25-18(15-6-9-23-10-7-19-17(23)12-15)20-8-11-24-13-16(21-22-24)14-4-2-1-3-5-14/h1-5,7,10,13,15H,6,8-9,11-12H2,(H,20,25)
InChIKeyRWCMVBSVPAYPEB-UHFFFAOYSA-N
XLogP1.52
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide with MolForge

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Related Compounds

N-[2-(4-methylphenyl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 112528929
N-[2-(2-methylsulfonylphenyl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 136565833
N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 112527700
5-oxo-N-[2-(4-phenyltriazol-1-yl)ethyl]-1,2,3,6,7,8-hexahydropyrrolizine-3-carboxamide
CID 166302288
N-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 110476602
N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 112529934
N-[2-(triazol-1-yl)phenyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 75472912
N-[[1-(4-methoxyphenyl)cyclobutyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 127832089
5-methoxy-N-[2-(4-phenyltriazol-1-yl)ethyl]pyridine-2-carboxamide
CID 146152132
N-pyrrolidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 112530767
N-[2-(4-phenyltriazol-1-yl)ethyl]azepane-1-sulfonamide
CID 136573990
3,4-difluoro-N-[2-(4-phenyltriazol-1-yl)ethyl]benzamide
CID 146152118

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
The IUPAC name of N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide (CID 166270149) is N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
The canonical SMILES for N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide is O=C(NCCn1cc(-c2ccccc2)nn1)C1CCn2ccnc2C1.
What is the InChIKey of N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
The InChIKey is RWCMVBSVPAYPEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O/c25-18(15-6-9-23-10-7-19-17(23)12-15)20-8-11-24-13-16(21-22-24)14-4-2-1-3-5-14/h1-5,7,10,13,15H,6,8-9,11-12H2,(H,20,25).
What are the key properties of N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide?
N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-phenyltriazol-1-yl)ethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide is sourced from PubChem (CID 166270149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).