N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide

C15H14N4OS — CID 108729336

IUPACN-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide
SMILESO=C(NCCc1[nH]cnc1-c1cccs1)c1ccncc1
InChIInChI=1S/C15H14N4OS/c20-15(11-3-6-16-7-4-11)17-8-5-12-14(19-10-18-12)13-2-1-9-21-13/h1-4,6-7,9-10H,5,8H2,(H,17,20)(H,18,19)
InChIKeyKCULQMKZHWHIFK-UHFFFAOYSA-N
MW298.37 g/mol
LogP2.51
Rot. Bonds5

About N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide

N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide (PubChem CID 108729336) has the molecular formula C15H14N4OS and a molecular weight of 298.37 g/mol. Its IUPAC name is N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide
PubChem CID108729336
Molecular FormulaC15H14N4OS
Molecular Weight298.37 g/mol
Exact Mass298.09
IUPAC NameN-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide
SMILESO=C(NCCc1[nH]cnc1-c1cccs1)c1ccncc1
InChIInChI=1S/C15H14N4OS/c20-15(11-3-6-16-7-4-11)17-8-5-12-14(19-10-18-12)13-2-1-9-21-13/h1-4,6-7,9-10H,5,8H2,(H,17,20)(H,18,19)
InChIKeyKCULQMKZHWHIFK-UHFFFAOYSA-N
XLogP2.51
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-propan-2-yl-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]benzamide
CID 108729363
N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyrazine-2-carboxamide
CID 108729429
[4-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethylcarbamoyl]phenyl] acetate
CID 108729293
3,4,5-triethoxy-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]benzamide
CID 108753078
2,6-dimethoxy-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]benzamide
CID 108753068
1,1-diethyl-3-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]urea
CID 108729375
4-(dimethylamino)-3-nitro-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]benzamide
CID 108729318
3,6-dichloro-2-methoxy-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]benzamide
CID 108729299
4-(4-methylphenyl)-4-oxo-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]butanamide
CID 108729411
5-methyl-1-pyridin-2-yl-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyrazole-4-carboxamide
CID 108729406
2-cyclohexyl-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]acetamide
CID 108753044
4-(6-methyl-4-oxochromen-2-yl)-N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]benzamide
CID 108811342

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide (CID 108729336) is N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide is O=C(NCCc1[nH]cnc1-c1cccs1)c1ccncc1.
What is the InChIKey of N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide?
The InChIKey is KCULQMKZHWHIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4OS/c20-15(11-3-6-16-7-4-11)17-8-5-12-14(19-10-18-12)13-2-1-9-21-13/h1-4,6-7,9-10H,5,8H2,(H,17,20)(H,18,19).
What are the key properties of N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide?
N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 108729336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).