N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide

C10H10ClN5O — CID 102989504

IUPACN-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide
SMILESO=C(CCn1ccnc1)Nc1nccnc1Cl
InChIInChI=1S/C10H10ClN5O/c11-9-10(14-3-2-13-9)15-8(17)1-5-16-6-4-12-7-16/h2-4,6-7H,1,5H2,(H,14,15,17)
InChIKeyPEIPGYYFNYKMHV-UHFFFAOYSA-N
MW251.68 g/mol
LogP1.36
Rot. Bonds4

About N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide

N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide (PubChem CID 102989504) has the molecular formula C10H10ClN5O and a molecular weight of 251.68 g/mol. Its IUPAC name is N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide
PubChem CID102989504
Molecular FormulaC10H10ClN5O
Molecular Weight251.68 g/mol
Exact Mass251.06
IUPAC NameN-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide
SMILESO=C(CCn1ccnc1)Nc1nccnc1Cl
InChIInChI=1S/C10H10ClN5O/c11-9-10(14-3-2-13-9)15-8(17)1-5-16-6-4-12-7-16/h2-4,6-7H,1,5H2,(H,14,15,17)
InChIKeyPEIPGYYFNYKMHV-UHFFFAOYSA-N
XLogP1.36
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.68
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chloro-2-pyridinyl)-3-imidazol-1-ylpropanamide
CID 115627274
N-(4-hydroxyphenyl)-3-imidazol-1-ylpropanamide
CID 28739593
N-(3-amino-4-chlorophenyl)-3-imidazol-1-ylpropanamide
CID 16791927
N-(6-bromo-3-pyridinyl)-3-imidazol-1-ylpropanamide
CID 103789490
3-imidazol-1-yl-N-(5-iodo-2-pyridinyl)propanamide
CID 65098547
3-imidazol-1-ylpropanoyl chloride
CID 19872160
N-(5-tert-butyl-1H-pyrazol-3-yl)-3-imidazol-1-ylpropanamide
CID 112688400
3-imidazol-1-yl-N-(4-sulfamoylphenyl)propanamide
CID 60647736
N-(3-chlorophenyl)-3-(3-imidazol-1-ylpropanoylamino)benzamide
CID 51124263
N-(2,3-dimethylphenyl)-3-imidazol-1-ylpropanamide
CID 46339273
6-(3-imidazol-1-ylpropanoylamino)pyridine-2-carboxylic acid
CID 63643768
3-imidazol-1-ylpropanoic acid;hydrate
CID 174578472

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide?
The IUPAC name of N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide (CID 102989504) is N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide.
What is the SMILES notation for N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide?
The canonical SMILES for N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide is O=C(CCn1ccnc1)Nc1nccnc1Cl.
What is the InChIKey of N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide?
The InChIKey is PEIPGYYFNYKMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5O/c11-9-10(14-3-2-13-9)15-8(17)1-5-16-6-4-12-7-16/h2-4,6-7H,1,5H2,(H,14,15,17).
What are the key properties of N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide?
N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide has a molecular weight of 251.68 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropyrazin-2-yl)-3-imidazol-1-ylpropanamide is sourced from PubChem (CID 102989504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).