N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide

C19H18N4O — CID 51935910

IUPACN-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
SMILESO=C(C[C@H]1C=CCC1)Nc1ccc(-n2cnc3ccccc32)nc1
InChIInChI=1S/C19H18N4O/c24-19(11-14-5-1-2-6-14)22-15-9-10-18(20-12-15)23-13-21-16-7-3-4-8-17(16)23/h1,3-5,7-10,12-14H,2,6,11H2,(H,22,24)/t14-/m0/s1
InChIKeyZEWJUXNRMUEMNP-AWEZNQCLSA-N
MW318.38 g/mol
LogP3.72
Rot. Bonds4

About N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide

N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide (PubChem CID 51935910) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide.

Molecular Properties

Compound NameN-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
PubChem CID51935910
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC NameN-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
SMILESO=C(C[C@H]1C=CCC1)Nc1ccc(-n2cnc3ccccc32)nc1
InChIInChI=1S/C19H18N4O/c24-19(11-14-5-1-2-6-14)22-15-9-10-18(20-12-15)23-13-21-16-7-3-4-8-17(16)23/h1,3-5,7-10,12-14H,2,6,11H2,(H,22,24)/t14-/m0/s1
InChIKeyZEWJUXNRMUEMNP-AWEZNQCLSA-N
XLogP3.72
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopent-2-en-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
CID 43041645
N-[6-(benzimidazol-1-yl)-3-pyridinyl]pentanamide
CID 134004728
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(2-fluorophenyl)acetamide
CID 134004771
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(4-bromophenyl)-4-oxobutanamide
CID 56532152
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide
CID 55632014
2-[(1S)-cyclopent-2-en-1-yl]-N-[6-(3-oxopiperazin-1-yl)-3-pyridinyl]acetamide
CID 38940674
3-(1-adamantylcarbamoylamino)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]propanamide
CID 55581086
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(4-oxocinnolin-1-yl)acetamide
CID 134004829
2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide
CID 134004763
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-fluorobenzamide
CID 134004736
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 134004746
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 51077289

Frequently Asked Questions

What is the IUPAC name of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
The IUPAC name of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide (CID 51935910) is N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide.
What is the SMILES notation for N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
The canonical SMILES for N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide is O=C(C[C@H]1C=CCC1)Nc1ccc(-n2cnc3ccccc32)nc1.
What is the InChIKey of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
The InChIKey is ZEWJUXNRMUEMNP-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H18N4O/c24-19(11-14-5-1-2-6-14)22-15-9-10-18(20-12-15)23-13-21-16-7-3-4-8-17(16)23/h1,3-5,7-10,12-14H,2,6,11H2,(H,22,24)/t14-/m0/s1.
What are the key properties of N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide has a molecular weight of 318.38 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide is sourced from PubChem (CID 51935910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).