N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide

C16H19N3O — CID 110704348

IUPACN-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide
SMILESO=C(NCCC1=CCCCC1)c1cccn2ccnc12
InChIInChI=1S/C16H19N3O/c20-16(18-9-8-13-5-2-1-3-6-13)14-7-4-11-19-12-10-17-15(14)19/h4-5,7,10-12H,1-3,6,8-9H2,(H,18,20)
InChIKeyMQMRTQZGIOKVKP-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.95
Rot. Bonds4

About N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide

N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide (PubChem CID 110704348) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide
PubChem CID110704348
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide
SMILESO=C(NCCC1=CCCCC1)c1cccn2ccnc12
InChIInChI=1S/C16H19N3O/c20-16(18-9-8-13-5-2-1-3-6-13)14-7-4-11-19-12-10-17-15(14)19/h4-5,7,10-12H,1-3,6,8-9H2,(H,18,20)
InChIKeyMQMRTQZGIOKVKP-UHFFFAOYSA-N
XLogP2.95
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-N-[2-(cyclohexen-1-yl)ethyl]pyridine-3-carboxamide
CID 103751992
N-[2-(cyclohexen-1-yl)ethyl]-2-(methylamino)benzamide
CID 61377844
N-propylimidazo[1,2-a]pyridine-8-carboxamide
CID 110704336
2-chloro-N-[2-(cyclohexen-1-yl)ethyl]benzamide
CID 835623
N-[2-(cyclohexen-1-yl)ethyl]-3-hydroxypyridine-2-carboxamide
CID 113229799
N-[2-(cyclohexen-1-yl)ethyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 110849180
N-[2-(cyclohexen-1-yl)ethyl]-2-(trifluoromethylsulfonyl)pyridine-3-carboxamide
CID 71881401
N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 87051260
2-amino-N-[2-(cyclohexen-1-yl)ethyl]-3-methylbenzamide
CID 60682672
N-[2-(cyclopenten-1-yl)ethyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167796987
N-[2-(cyclohexen-1-yl)ethyl]-2-[2-oxo-2-(2-phenylethylamino)ethyl]sulfanylpyridine-3-carboxamide
CID 5151631
N-[2-[2-(cyclohexen-1-yl)ethylcarbamoyl]-6-methylphenyl]pyridine-4-carboxamide
CID 47802697

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide?
The IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide (CID 110704348) is N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide?
The canonical SMILES for N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide is O=C(NCCC1=CCCCC1)c1cccn2ccnc12.
What is the InChIKey of N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide?
The InChIKey is MQMRTQZGIOKVKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c20-16(18-9-8-13-5-2-1-3-6-13)14-7-4-11-19-12-10-17-15(14)19/h4-5,7,10-12H,1-3,6,8-9H2,(H,18,20).
What are the key properties of N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide?
N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-8-carboxamide is sourced from PubChem (CID 110704348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).